Molecule FYI-1007414

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Molecule Summary:

ID: FYI-1007414
Names:
InChIKey: DQJIPLBLBSCDMP-UHFFFAOYSA-N
SMILES: O=C(O)CC(=O)S

Received at FYIcenter.com on: 2024-02-21

Molecule ID: FYI-1007414 Edit

Molecule Structure InChIKey: DQJIPLBLBSCDMP-UHFFFAOYSA-N

Molecule Structure SMILES String: O=C(O)CC(=O)S

Download SDF Download SVG Structure in 2D SDF:

FYI-1007414
FYIcenter.com

  7  6  0  0  0  0  0  0  0  0999 V2000
    4.8497    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  2  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  2  0  0  0  0
  7  5  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1007414-3D
FYIcenter.com

 11 10  0     0  0  0  0  0  0999 V2000
    2.6810    0.8073    0.3297 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3948    0.8477   -0.0755 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2284   -1.2708   -0.3108 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3855   -1.1399    0.3622 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0313    0.7791   -0.2472 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124   -0.0630   -0.1052 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3102    0.0396    0.0469 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0123    1.6222    0.4508 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0691    1.1525   -1.2758 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1843    2.0526    0.3024 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2299    0.3704    0.1171 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  1  0  0  0  0
  1 10  1  0  0  0  0
  2  7  1  0  0  0  0
  2 11  1  0  0  0  0
  3  6  2  0  0  0  0
  4  7  2  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5  8  1  0  0  0  0
  5  9  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2024-02-28, 948👍, 0💬

Molecule FYI-1007414
Molecule Summary: ID: FYI-1007414 Names: InChIKey: DQJIPLBLBSCDMP-UHFFFAOYSA-N SMILES: O=C(O)CC(=O)S Received at FYIcenter.com on: 2024-02-21 2024-02-28, 950🔥, 0💬

Molecule FYI-1007415
Molecule Summary: ID: FYI-1007415 Names: InChIKey: IVMHUPZOHKZLPZ-JHYFKHSXSA-N SMILES: Cc5nc([C@@H]3O[C@H](CO)[C@H](O )C(n2cc(c1cc(F)c(F)c(F)c1)nn2) [C@H]3O)n(c4cc(Cl)ccc4Cl)n5Received at FYIcenter.com on: 2024-02-21 2024-02-28, 895🔥, 0💬

Molecule FYI-1007411
Molecule Summary: ID: FYI-1007411 Names: InChIKey: FFAADXOKPZHULO-UHFFFAOYSA-N SMILES: CC(C)C(=O)S Received at FYIcenter.com on: 2024-02-21 2024-02-28, 864🔥, 0💬

Molecule FYI-1007413
Molecule Summary: ID: FYI-1007413 Names: InChIKey: DZLNHFMRPBPULJ-UHFFFAOYSA-N SMILES: O=C(O)C1CSCN1 Received at FYIcenter.com on: 2024-02-21 2024-02-28, 856🔥, 0💬

Molecule FYI-1007412
Molecule Summary: ID: FYI-1007412 Names: InChIKey: RTJQABCNNLMCJF-UHFFFAOYSA-N SMILES: CS(=O)(=O)c3ccc(c2cnc(N)c(c1cc c(C(F)(F)F)nc1)c2)cc3Received at FYIcenter.com on: 2024-02-21 2024-02-28, 644🔥, 0💬

Molecule FYI-1007418
Molecule Summary: ID: FYI-1007418 Names: InChIKey: DLXOPXXAQDKHCQ-UHFFFAOYSA-N SMILES: CC(CCc2cccc(COc1ccccc1)c2)(C(= O)C(=O)O)C(CS(O)(O)CN)C(O)CCOReceived at FYIcenter.com on: 2024-02-21 2024-02-28, 638🔥, 0💬

Molecule FYI-1007417
Molecule Summary: ID: FYI-1007417 Names: InChIKey: NEPYYAKQDZXIOZ-UHFFFAOYSA-N SMILES: CNC(=O)c4ccc(c2cn[c+]3cnc(C(=O )N(C)c1ccc(Cl)cc1)c[n+]23)cc4Received at FYIcenter.com on: 2024-02-21 2024-02-28, 622🔥, 0💬

Molecule FYI-1007409
Molecule Summary: ID: FYI-1007409 Names: InChIKey: ORCOTUBQRUWICQ-ZZXKWVIFSA-N SMILES: O=C(S)/C=C/c1ccc(O)cc1 Received at FYIcenter.com on: 2024-02-21 2024-02-28, 567🔥, 0💬

Molecule FYI-1007416
Molecule Summary: ID: FYI-1007416 Names: InChIKey: XOWVXIRCAYYBIV-UHFFFAOYSA-N SMILES: CS(=O)(=O)c3ccc(c2cnc(N)c(c1cc c(C(F)(F)F)cc1)c2)cc3Received at FYIcenter.com on: 2024-02-21 2024-02-28, 552🔥, 0💬

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