ethyl 2-[[1-(4-chlorophenyl)carbonylpiperidin-4-yl]carbonylamino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[1-(4-chlorophenyl)carbonylpiperidin-4-yl]carbonylamino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[1-(4-chlorobenzoyl)piperidine-4-carbonyl]amino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate CAS Name: 2-[[[1-[(4-chlorophenyl)-oxomethyl]-4-piperidinyl]-oxomethyl]amino]-4-methyl-5-(methylcarbamoyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[1-(4-chlorobenzoyl)piperidine-4-carbonyl]amino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate Traditional Name: 2-[[1-(4-chlorobenzoyl)isonipecotoyl]amino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylic acid ethyl ester Formula: C23H26ClN3O5S MolecularWeight: 491.98764

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H26ClN3O5S/c1-4-32-23(31)17-13(2)18(20(29)25-3)33-21(17)26-19(28)14-9-11-27(12-10-14)22(30)15-5-7-16(24)8-6-15/h5-8,14H,4,9-12H2,1-3H3,(H,25,29)(H,26,28)