[2-[2-cyanoethyl(methyl)amino]-2-oxidanylidene-ethyl] 5-(4-chlorophenyl)thiophene-2-carboxylate

Systemtic Name: [2-[2-cyanoethyl(methyl)amino]-2-oxidanylidene-ethyl] 5-(4-chlorophenyl)thiophene-2-carboxylate Openeye Name: [2-[2-cyanoethyl(methyl)amino]-2-oxo-ethyl] 5-(4-chlorophenyl)thiophene-2-carboxylate CAS Name: 5-(4-chlorophenyl)-2-thiophenecarboxylic acid [2-[2-cyanoethyl(methyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[2-cyanoethyl(methyl)amino]-2-oxoethyl] 5-(4-chlorophenyl)thiophene-2-carboxylate Traditional Name: 5-(4-chlorophenyl)thiophene-2-carboxylic acid [2-[2-cyanoethyl(methyl)amino]-2-keto-ethyl] ester Formula: C17H15ClN2O3S MolecularWeight: 362.8306

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)COC(=O)C1=CC=C(S1)C2=CC=C(C=C2)Cl

Isomeric SMILES

CN(CCC#N)C(=O)COC(=O)C1=CC=C(S1)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H15ClN2O3S/c1-20(10-2-9-19)16(21)11-23-17(22)15-8-7-14(24-15)12-3-5-13(18)6-4-12/h3-8H,2,10-11H2,1H3