methyl 4-methyl-3-[(1-thiophen-2-ylcarbonylpiperidin-4-yl)carbonylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[(1-thiophen-2-ylcarbonylpiperidin-4-yl)carbonylamino]benzoate Openeye Name: methyl 4-methyl-3-[[1-(thiophene-2-carbonyl)piperidine-4-carbonyl]amino]benzoate CAS Name: 4-methyl-3-[[oxo-[1-[oxo(thiophen-2-yl)methyl]-4-piperidinyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[1-(thiophene-2-carbonyl)piperidine-4-carbonyl]amino]benzoate Traditional Name: 4-methyl-3-[[1-(2-thenoyl)isonipecotoyl]amino]benzoic acid methyl ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2CCN(CC2)C(=O)C3=CC=CS3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2CCN(CC2)C(=O)C3=CC=CS3

InChI

InChI=1S/C20H22N2O4S/c1-13-5-6-15(20(25)26-2)12-16(13)21-18(23)14-7-9-22(10-8-14)19(24)17-4-3-11-27-17/h3-6,11-12,14H,7-10H2,1-2H3,(H,21,23)