N-[[3-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamothioyl]-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[[3-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamothioyl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[[3-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamothioyl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[[3-[(4-methoxyphenyl)sulfamoyl]anilino]-sulfanylidenemethyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[[3-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamothioyl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[[3-[(4-methoxyphenyl)sulfamoyl]phenyl]thiocarbamoyl]-4-pyrrolidinosulfonyl-benzamide Formula: C25H26N4O6S3 MolecularWeight: 574.69214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)NC(=S)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)NC(=S)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C25H26N4O6S3/c1-35-21-11-9-19(10-12-21)28-37(31,32)23-6-4-5-20(17-23)26-25(36)27-24(30)18-7-13-22(14-8-18)38(33,34)29-15-2-3-16-29/h4-14,17,28H,2-3,15-16H2,1H3,(H2,26,27,30,36)