methyl 2-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-methyl-imidazole-4-carboxylate

Systemtic Name: methyl 2-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-methyl-imidazole-4-carboxylate Openeye Name: methyl 2-[2-(4-chloroanilino)-2-oxo-ethyl]sulfanyl-3-methyl-imidazole-4-carboxylate CAS Name: 2-[[2-(4-chloroanilino)-2-oxoethyl]thio]-3-methyl-4-imidazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[2-(4-chloroanilino)-2-oxoethyl]sulfanyl-3-methylimidazole-4-carboxylate Traditional Name: 2-[[2-(4-chloroanilino)-2-keto-ethyl]thio]-3-methyl-imidazole-4-carboxylic acid methyl ester Formula: C14H14ClN3O3S MolecularWeight: 339.79726

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1SCC(=O)NC2=CC=C(C=C2)Cl)C(=O)OC

Isomeric SMILES

CN1C(=CN=C1SCC(=O)NC2=CC=C(C=C2)Cl)C(=O)OC

InChI

InChI=1S/C14H14ClN3O3S/c1-18-11(13(20)21-2)7-16-14(18)22-8-12(19)17-10-5-3-9(15)4-6-10/h3-7H,8H2,1-2H3,(H,17,19)