methyl 5-methyl-2-[2-[4-(2-methylphenyl)piperazin-1-yl]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 5-methyl-2-[2-[4-(2-methylphenyl)piperazin-1-yl]ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 5-methyl-2-[[2-[4-(o-tolyl)piperazin-1-yl]acetyl]amino]thiophene-3-carboxylate CAS Name: 5-methyl-2-[[2-[4-(2-methylphenyl)-1-piperazinyl]-1-oxoethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-2-[[2-[4-(2-methylphenyl)piperazin-1-yl]acetyl]amino]thiophene-3-carboxylate Traditional Name: 5-methyl-2-[[2-[4-(o-tolyl)piperazino]acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C20H25N3O3S MolecularWeight: 387.4958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)CC(=O)NC3=C(C=C(S3)C)C(=O)OC

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)CC(=O)NC3=C(C=C(S3)C)C(=O)OC

InChI

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