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

Systemtic Name: 3-[cyclohexyl(sulfanylcarbamoyl)amino]propyl 4-[(4-methylphenyl)sulfonylcarbamoylamino]benzoate Openeye Name: 3-[cyclohexyl(sulfanylcarbamoyl)amino]propyl 4-(p-tolylsulfonylcarbamoylamino)benzoate CAS Name: 4-[[[(4-methylphenyl)sulfonylamino]-oxomethyl]amino]benzoic acid 3-[cyclohexyl-[(mercaptoamino)-oxomethyl]amino]propyl ester IUPAC Name: 3-[cyclohexyl(sulfanylcarbamoyl)amino]propyl 4-[(4-methylphenyl)sulfonylcarbamoylamino]benzoate Traditional Name: 4-(tosylcarbamoylamino)benzoic acid 3-[cyclohexyl(mercaptocarbamoyl)amino]propyl ester Formula: C25H32N4O6S2 MolecularWeight: 548.67478

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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(C3CCCCC3)C(=O)NS

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=CC=C(C=C2)C(=O)OCCCN(C3CCCCC3)C(=O)NS

InChI

InChI=1S/C25H32N4O6S2/c1-18-8-14-22(15-9-18)37(33,34)28-24(31)26-20-12-10-19(11-13-20)23(30)35-17-5-16-29(25(32)27-36)21-6-3-2-4-7-21/h8-15,21,36H,2-7,16-17H2,1H3,(H,27,32)(H2,26,28,31)