[2-(cyclopropylcarbamoylamino)-2-oxidanylidene-ethyl] 3-[(4-chlorophenyl)sulfanylmethyl]benzoate

Systemtic Name: [2-(cyclopropylcarbamoylamino)-2-oxidanylidene-ethyl] 3-[(4-chlorophenyl)sulfanylmethyl]benzoate Openeye Name: [2-(cyclopropylcarbamoylamino)-2-oxo-ethyl] 3-[(4-chlorophenyl)sulfanylmethyl]benzoate CAS Name: 3-[[(4-chlorophenyl)thio]methyl]benzoic acid [2-[[(cyclopropylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(cyclopropylcarbamoylamino)-2-oxoethyl] 3-[(4-chlorophenyl)sulfanylmethyl]benzoate Traditional Name: 3-[[(4-chlorophenyl)thio]methyl]benzoic acid [2-(cyclopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C20H19ClN2O4S MolecularWeight: 418.89386

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)NC(=O)COC(=O)C2=CC(=CC=C2)CSC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CC1NC(=O)NC(=O)COC(=O)C2=CC(=CC=C2)CSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H19ClN2O4S/c21-15-4-8-17(9-5-15)28-12-13-2-1-3-14(10-13)19(25)27-11-18(24)23-20(26)22-16-6-7-16/h1-5,8-10,16H,6-7,11-12H2,(H2,22,23,24,26)