ethyl 5-[(4-chlorophenyl)carbonylamino]-3-(2-methoxyphenyl)-2-methylsulfanyl-imidazole-4-carboxylate

Systemtic Name: ethyl 5-[(4-chlorophenyl)carbonylamino]-3-(2-methoxyphenyl)-2-methylsulfanyl-imidazole-4-carboxylate Openeye Name: ethyl 5-[(4-chlorobenzoyl)amino]-3-(2-methoxyphenyl)-2-methylsulfanyl-imidazole-4-carboxylate CAS Name: 5-[[(4-chlorophenyl)-oxomethyl]amino]-3-(2-methoxyphenyl)-2-(methylthio)-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-chlorobenzoyl)amino]-3-(2-methoxyphenyl)-2-methylsulfanylimidazole-4-carboxylate Traditional Name: 5-[(4-chlorobenzoyl)amino]-3-(2-methoxyphenyl)-2-(methylthio)imidazole-4-carboxylic acid ethyl ester Formula: C21H20ClN3O4S MolecularWeight: 445.9192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N1C2=CC=CC=C2OC)SC)NC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(N=C(N1C2=CC=CC=C2OC)SC)NC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H20ClN3O4S/c1-4-29-20(27)17-18(23-19(26)13-9-11-14(22)12-10-13)24-21(30-3)25(17)15-7-5-6-8-16(15)28-2/h5-12H,4H2,1-3H3,(H,23,26)