[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl] 2-(3-chlorophenyl)-5-methyl-1,2,3-triazole-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl] 2-(3-chlorophenyl)-5-methyl-1,2,3-triazole-4-carboxylate Openeye Name: [2-oxo-2-[2-(2-thienyl)ethylamino]ethyl] 2-(3-chlorophenyl)-5-methyl-triazole-4-carboxylate CAS Name: 2-(3-chlorophenyl)-5-methyl-4-triazolecarboxylic acid [2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] 2-(3-chlorophenyl)-5-methyltriazole-4-carboxylate Traditional Name: 2-(3-chlorophenyl)-5-methyl-triazole-4-carboxylic acid [2-keto-2-[2-(2-thienyl)ethylamino]ethyl] ester Formula: C18H17ClN4O3S MolecularWeight: 404.87058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)OCC(=O)NCCC2=CC=CS2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=NN(N=C1C(=O)OCC(=O)NCCC2=CC=CS2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H17ClN4O3S/c1-12-17(22-23(21-12)14-5-2-4-13(19)10-14)18(25)26-11-16(24)20-8-7-15-6-3-9-27-15/h2-6,9-10H,7-8,11H2,1H3,(H,20,24)