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

Systemtic Name: methyl 4-ethyl-5-methyl-2-[2-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4-ethyl-5-methyl-2-[[2-[3-methyl-4-(p-tolyl)piperazin-1-yl]acetyl]amino]thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-[[2-[3-methyl-4-(4-methylphenyl)-1-piperazinyl]-1-oxoethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-ethyl-5-methyl-2-[[2-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-ethyl-5-methyl-2-[[2-[3-methyl-4-(p-tolyl)piperazino]acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OC)NC(=O)CN2CCN(C(C2)C)C3=CC=C(C=C3)C)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OC)NC(=O)CN2CCN(C(C2)C)C3=CC=C(C=C3)C)C

InChI

InChI=1S/C23H31N3O3S/c1-6-19-17(4)30-22(21(19)23(28)29-5)24-20(27)14-25-11-12-26(16(3)13-25)18-9-7-15(2)8-10-18/h7-10,16H,6,11-14H2,1-5H3,(H,24,27)