S-[2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl] N-(4-chlorophenyl)-N-methyl-carbamothioate

Systemtic Name: S-[2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl] N-(4-chlorophenyl)-N-methyl-carbamothioate Openeye Name: S-[2-(2-nitroanilino)-2-oxo-ethyl] N-(4-chlorophenyl)-N-methyl-carbamothioate CAS Name: N-(4-chlorophenyl)-N-methylcarbamothioic acid S-[2-(2-nitroanilino)-2-oxoethyl] ester IUPAC Name: S-[2-(2-nitroanilino)-2-oxoethyl] N-(4-chlorophenyl)-N-methylcarbamothioate Traditional Name: N-(4-chlorophenyl)-N-methyl-thiocarbamic acid S-[2-keto-2-(2-nitroanilino)ethyl] ester Formula: C16H14ClN3O4S MolecularWeight: 379.81806

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)Cl)C(=O)SCC(=O)NC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CN(C1=CC=C(C=C1)Cl)C(=O)SCC(=O)NC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H14ClN3O4S/c1-19(12-8-6-11(17)7-9-12)16(22)25-10-15(21)18-13-4-2-3-5-14(13)20(23)24/h2-9H,10H2,1H3,(H,18,21)