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

Systemtic Name: 2-[3-[(4-methylphenyl)carbamothioylamino]phenyl]sulfanyl-N-(4-sulfamoylphenyl)propanamide Openeye Name: 2-[3-(p-tolylcarbamothioylamino)phenyl]sulfanyl-N-(4-sulfamoylphenyl)propanamide CAS Name: 2-[[3-[[(4-methylanilino)-sulfanylidenemethyl]amino]phenyl]thio]-N-(4-sulfamoylphenyl)propanamide IUPAC Name: 2-[3-[(4-methylphenyl)carbamothioylamino]phenyl]sulfanyl-N-(4-sulfamoylphenyl)propanamide Traditional Name: 2-[[3-(p-tolylthiocarbamoylamino)phenyl]thio]-N-(4-sulfamoylphenyl)propionamide Formula: C23H24N4O3S3 MolecularWeight: 500.65666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NC2=CC(=CC=C2)SC(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)NC2=CC(=CC=C2)SC(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C23H24N4O3S3/c1-15-6-8-18(9-7-15)26-23(31)27-19-4-3-5-20(14-19)32-16(2)22(28)25-17-10-12-21(13-11-17)33(24,29)30/h3-14,16H,1-2H3,(H,25,28)(H2,24,29,30)(H2,26,27,31)