2-[3-[(4-methylphenyl)carbamothioylamino]phenyl]sulfanyl-N-(4-sulfamoylphenyl)butanamide

Systemtic Name: 2-[3-[(4-methylphenyl)carbamothioylamino]phenyl]sulfanyl-N-(4-sulfamoylphenyl)butanamide Openeye Name: 2-[3-(p-tolylcarbamothioylamino)phenyl]sulfanyl-N-(4-sulfamoylphenyl)butanamide CAS Name: 2-[[3-[[(4-methylanilino)-sulfanylidenemethyl]amino]phenyl]thio]-N-(4-sulfamoylphenyl)butanamide IUPAC Name: 2-[3-[(4-methylphenyl)carbamothioylamino]phenyl]sulfanyl-N-(4-sulfamoylphenyl)butanamide Traditional Name: 2-[[3-(p-tolylthiocarbamoylamino)phenyl]thio]-N-(4-sulfamoylphenyl)butyramide Formula: C24H26N4O3S3 MolecularWeight: 514.68324

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)SC2=CC=CC(=C2)NC(=S)NC3=CC=C(C=C3)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)SC2=CC=CC(=C2)NC(=S)NC3=CC=C(C=C3)C

InChI

InChI=1S/C24H26N4O3S3/c1-3-22(23(29)26-17-11-13-21(14-12-17)34(25,30)31)33-20-6-4-5-19(15-20)28-24(32)27-18-9-7-16(2)8-10-18/h4-15,22H,3H2,1-2H3,(H,26,29)(H2,25,30,31)(H2,27,28,32)