methyl 4-methyl-2-(2-phenylethanoylamino)-5-piperidin-1-ylcarbonyl-thiophene-3-carboxylate

Systemtic Name: methyl 4-methyl-2-(2-phenylethanoylamino)-5-piperidin-1-ylcarbonyl-thiophene-3-carboxylate Openeye Name: methyl 4-methyl-2-[(2-phenylacetyl)amino]-5-(piperidine-1-carbonyl)thiophene-3-carboxylate CAS Name: 4-methyl-2-[(1-oxo-2-phenylethyl)amino]-5-[oxo(1-piperidinyl)methyl]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-2-[(2-phenylacetyl)amino]-5-(piperidine-1-carbonyl)thiophene-3-carboxylate Traditional Name: 4-methyl-2-[(2-phenylacetyl)amino]-5-(piperidine-1-carbonyl)thiophene-3-carboxylic acid methyl ester Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CC2=CC=CC=C2)C(=O)N3CCCCC3

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CC2=CC=CC=C2)C(=O)N3CCCCC3

InChI

InChI=1S/C21H24N2O4S/c1-14-17(21(26)27-2)19(22-16(24)13-15-9-5-3-6-10-15)28-18(14)20(25)23-11-7-4-8-12-23/h3,5-6,9-10H,4,7-8,11-13H2,1-2H3,(H,22,24)