ethyl 2-[2-[4-(2-chlorophenyl)piperazin-1-yl]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[4-(2-chlorophenyl)piperazin-1-yl]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[4-(2-chlorophenyl)piperazin-1-yl]acetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[2-[4-(2-chlorophenyl)-1-piperazinyl]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[4-(2-chlorophenyl)piperazin-1-yl]acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-[4-(2-chlorophenyl)piperazino]acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C19H22ClN3O3S MolecularWeight: 407.91428

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1)NC(=O)CN2CCN(CC2)C3=CC=CC=C3Cl

Isomeric SMILES

CCOC(=O)C1=C(SC=C1)NC(=O)CN2CCN(CC2)C3=CC=CC=C3Cl

InChI

InChI=1S/C19H22ClN3O3S/c1-2-26-19(25)14-7-12-27-18(14)21-17(24)13-22-8-10-23(11-9-22)16-6-4-3-5-15(16)20/h3-7,12H,2,8-11,13H2,1H3,(H,21,24)