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

Systemtic Name: ethyl 2-[2-[4-(2-methylphenyl)piperazin-1-yl]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[4-(o-tolyl)piperazin-1-yl]acetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[2-[4-(2-methylphenyl)-1-piperazinyl]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[4-(2-methylphenyl)piperazin-1-yl]acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-[4-(o-tolyl)piperazino]acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C20H25N3O3S MolecularWeight: 387.4958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1)NC(=O)CN2CCN(CC2)C3=CC=CC=C3C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1)NC(=O)CN2CCN(CC2)C3=CC=CC=C3C

InChI

InChI=1S/C20H25N3O3S/c1-3-26-20(25)16-8-13-27-19(16)21-18(24)14-22-9-11-23(12-10-22)17-7-5-4-6-15(17)2/h4-8,13H,3,9-12,14H2,1-2H3,(H,21,24)