4-[butyl(sulfanylcarbamoyl)amino]butyl 3-[(4-methylphenyl)sulfonylcarbamoylamino]benzoate

Systemtic Name: 4-[butyl(sulfanylcarbamoyl)amino]butyl 3-[(4-methylphenyl)sulfonylcarbamoylamino]benzoate Openeye Name: 4-[butyl(sulfanylcarbamoyl)amino]butyl 3-(p-tolylsulfonylcarbamoylamino)benzoate CAS Name: 3-[[[(4-methylphenyl)sulfonylamino]-oxomethyl]amino]benzoic acid 4-[butyl-[(mercaptoamino)-oxomethyl]amino]butyl ester IUPAC Name: 4-[butyl(sulfanylcarbamoyl)amino]butyl 3-[(4-methylphenyl)sulfonylcarbamoylamino]benzoate Traditional Name: 3-(tosylcarbamoylamino)benzoic acid 4-[butyl(mercaptocarbamoyl)amino]butyl ester Formula: C24H32N4O6S2 MolecularWeight: 536.66408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCCOC(=O)C1=CC(=CC=C1)NC(=O)NS(=O)(=O)C2=CC=C(C=C2)C)C(=O)NS

Isomeric SMILES

CCCCN(CCCCOC(=O)C1=CC(=CC=C1)NC(=O)NS(=O)(=O)C2=CC=C(C=C2)C)C(=O)NS

InChI

InChI=1S/C24H32N4O6S2/c1-3-4-14-28(24(31)26-35)15-5-6-16-34-22(29)19-8-7-9-20(17-19)25-23(30)27-36(32,33)21-12-10-18(2)11-13-21/h7-13,17,35H,3-6,14-16H2,1-2H3,(H,26,31)(H2,25,27,30)