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

Systemtic Name: methyl 4-(4-methylphenyl)-2-[2-(3-methylpiperidin-1-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 2-[[2-(3-methyl-1-piperidyl)acetyl]amino]-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 4-(4-methylphenyl)-2-[[2-(3-methyl-1-piperidinyl)-1-oxoethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-methylphenyl)-2-[[2-(3-methylpiperidin-1-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-(3-methylpiperidino)acetyl]amino]-4-(p-tolyl)thiophene-3-carboxylic acid methyl ester Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CC(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)C)C(=O)OC

Isomeric SMILES

CC1CCCN(C1)CC(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)C)C(=O)OC

InChI

InChI=1S/C21H26N2O3S/c1-14-6-8-16(9-7-14)17-13-27-20(19(17)21(25)26-3)22-18(24)12-23-10-4-5-15(2)11-23/h6-9,13,15H,4-5,10-12H2,1-3H3,(H,22,24)