3-[[(4-methoxyphenyl)-sulfanyl-carbamoyl]amino]propyl 4-[(4-methylphenyl)sulfonylcarbamoylamino]benzoate

Systemtic Name: 3-[[(4-methoxyphenyl)-sulfanyl-carbamoyl]amino]propyl 4-[(4-methylphenyl)sulfonylcarbamoylamino]benzoate Openeye Name: 3-[[(4-methoxyphenyl)-sulfanyl-carbamoyl]amino]propyl 4-(p-tolylsulfonylcarbamoylamino)benzoate CAS Name: 4-[[[(4-methylphenyl)sulfonylamino]-oxomethyl]amino]benzoic acid 3-[[(N-mercapto-4-methoxyanilino)-oxomethyl]amino]propyl ester IUPAC Name: 3-[[(4-methoxyphenyl)-sulfanylcarbamoyl]amino]propyl 4-[(4-methylphenyl)sulfonylcarbamoylamino]benzoate Traditional Name: 4-(tosylcarbamoylamino)benzoic acid 3-[[mercapto-(4-methoxyphenyl)carbamoyl]amino]propyl ester Formula: C26H28N4O7S2 MolecularWeight: 572.65312

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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)OCCCNC(=O)N(C3=CC=C(C=C3)OC)S

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=CC=C(C=C2)C(=O)OCCCNC(=O)N(C3=CC=C(C=C3)OC)S

InChI

InChI=1S/C26H28N4O7S2/c1-18-4-14-23(15-5-18)39(34,35)29-25(32)28-20-8-6-19(7-9-20)24(31)37-17-3-16-27-26(33)30(38)21-10-12-22(36-2)13-11-21/h4-15,38H,3,16-17H2,1-2H3,(H,27,33)(H2,28,29,32)