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

Systemtic Name: ethyl 2-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]acetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[2-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-[4-(4-chlorobenzyl)piperazino]acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C20H24ClN3O3S MolecularWeight: 421.94086

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1)NC(=O)CN2CCN(CC2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC=C1)NC(=O)CN2CCN(CC2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H24ClN3O3S/c1-2-27-20(26)17-7-12-28-19(17)22-18(25)14-24-10-8-23(9-11-24)13-15-3-5-16(21)6-4-15/h3-7,12H,2,8-11,13-14H2,1H3,(H,22,25)