N-[[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidin-1-yl-phenyl]carbamothioyl]cyclohexanecarboxamide

Systemtic Name: N-[[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidin-1-yl-phenyl]carbamothioyl]cyclohexanecarboxamide Openeye Name: N-[[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidin-1-yl-phenyl]carbamothioyl]cyclohexanecarboxamide CAS Name: N-[[5-[(4-methoxyphenyl)sulfamoyl]-2-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]cyclohexanecarboxamide IUPAC Name: N-[[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidin-1-ylphenyl]carbamothioyl]cyclohexanecarboxamide Traditional Name: N-[[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidino-phenyl]thiocarbamoyl]cyclohexanecarboxamide Formula: C25H32N4O4S2 MolecularWeight: 516.67598

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)N3CCCC3)NC(=S)NC(=O)C4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)N3CCCC3)NC(=S)NC(=O)C4CCCCC4

InChI

InChI=1S/C25H32N4O4S2/c1-33-20-11-9-19(10-12-20)28-35(31,32)21-13-14-23(29-15-5-6-16-29)22(17-21)26-25(34)27-24(30)18-7-3-2-4-8-18/h9-14,17-18,28H,2-8,15-16H2,1H3,(H2,26,27,30,34)