[2-(cyclopropylcarbamoylamino)-2-oxidanylidene-ethyl] 2-(2-chlorophenyl)sulfanylpyridine-3-carboxylate

Systemtic Name: [2-(cyclopropylcarbamoylamino)-2-oxidanylidene-ethyl] 2-(2-chlorophenyl)sulfanylpyridine-3-carboxylate Openeye Name: [2-(cyclopropylcarbamoylamino)-2-oxo-ethyl] 2-(2-chlorophenyl)sulfanylpyridine-3-carboxylate CAS Name: 2-[(2-chlorophenyl)thio]-3-pyridinecarboxylic acid [2-[[(cyclopropylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(cyclopropylcarbamoylamino)-2-oxoethyl] 2-(2-chlorophenyl)sulfanylpyridine-3-carboxylate Traditional Name: 2-[(2-chlorophenyl)thio]nicotinic acid [2-(cyclopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C18H16ClN3O4S MolecularWeight: 405.85534

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)NC(=O)COC(=O)C2=C(N=CC=C2)SC3=CC=CC=C3Cl

Isomeric SMILES

C1CC1NC(=O)NC(=O)COC(=O)C2=C(N=CC=C2)SC3=CC=CC=C3Cl

InChI

InChI=1S/C18H16ClN3O4S/c19-13-5-1-2-6-14(13)27-16-12(4-3-9-20-16)17(24)26-10-15(23)22-18(25)21-11-7-8-11/h1-6,9,11H,7-8,10H2,(H2,21,22,23,25)