N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-(1,3-thiazol-4-ylmethylsulfanyl)benzamide

Systemtic Name: N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-(1,3-thiazol-4-ylmethylsulfanyl)benzamide Openeye Name: N-(2-hydroxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-(thiazol-4-ylmethylsulfanyl)benzamide CAS Name: N-[2-hydroxy-5-(1-pyrrolidinylsulfonyl)phenyl]-2-(4-thiazolylmethylthio)benzamide IUPAC Name: N-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)-2-(1,3-thiazol-4-ylmethylsulfanyl)benzamide Traditional Name: N-(2-hydroxy-5-pyrrolidinosulfonyl-phenyl)-2-(thiazol-4-ylmethylthio)benzamide Formula: C21H21N3O4S3 MolecularWeight: 475.60414

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)O)NC(=O)C3=CC=CC=C3SCC4=CSC=N4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)O)NC(=O)C3=CC=CC=C3SCC4=CSC=N4

InChI

InChI=1S/C21H21N3O4S3/c25-19-8-7-16(31(27,28)24-9-3-4-10-24)11-18(19)23-21(26)17-5-1-2-6-20(17)30-13-15-12-29-14-22-15/h1-2,5-8,11-12,14,25H,3-4,9-10,13H2,(H,23,26)