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

Systemtic Name: 3-[tert-butyl(sulfanylcarbamoyl)amino]propyl 4-[(4-methylphenyl)sulfonylcarbamoylamino]benzoate Openeye Name: 3-[tert-butyl(sulfanylcarbamoyl)amino]propyl 4-(p-tolylsulfonylcarbamoylamino)benzoate CAS Name: 4-[[[(4-methylphenyl)sulfonylamino]-oxomethyl]amino]benzoic acid 3-[tert-butyl-[(mercaptoamino)-oxomethyl]amino]propyl ester IUPAC Name: 3-[tert-butyl(sulfanylcarbamoyl)amino]propyl 4-[(4-methylphenyl)sulfonylcarbamoylamino]benzoate Traditional Name: 4-(tosylcarbamoylamino)benzoic acid 3-[tert-butyl(mercaptocarbamoyl)amino]propyl ester Formula: C23H30N4O6S2 MolecularWeight: 522.6375

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=CC=C(C=C2)C(=O)OCCCN(C(=O)NS)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=CC=C(C=C2)C(=O)OCCCN(C(=O)NS)C(C)(C)C

InChI

InChI=1S/C23H30N4O6S2/c1-16-6-12-19(13-7-16)35(31,32)26-21(29)24-18-10-8-17(9-11-18)20(28)33-15-5-14-27(22(30)25-34)23(2,3)4/h6-13,34H,5,14-15H2,1-4H3,(H,25,30)(H2,24,26,29)