methyl 2-[(1-ethanoylpiperidin-4-yl)carbonylamino]-4-(4-methylphenyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-[(1-ethanoylpiperidin-4-yl)carbonylamino]-4-(4-methylphenyl)thiophene-3-carboxylate Openeye Name: methyl 2-[(1-acetylpiperidine-4-carbonyl)amino]-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 2-[[(1-acetyl-4-piperidinyl)-oxomethyl]amino]-4-(4-methylphenyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(1-acetylpiperidine-4-carbonyl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate Traditional Name: 2-[(1-acetylisonipecotoyl)amino]-4-(p-tolyl)thiophene-3-carboxylic acid methyl ester Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)C3CCN(CC3)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)C3CCN(CC3)C(=O)C

InChI

InChI=1S/C21H24N2O4S/c1-13-4-6-15(7-5-13)17-12-28-20(18(17)21(26)27-3)22-19(25)16-8-10-23(11-9-16)14(2)24/h4-7,12,16H,8-11H2,1-3H3,(H,22,25)