ethyl 4-methyl-5-[(4-methylphenyl)carbamoyl]-2-(pyridin-3-ylcarbonylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-methyl-5-[(4-methylphenyl)carbamoyl]-2-(pyridin-3-ylcarbonylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-methyl-5-(p-tolylcarbamoyl)-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate CAS Name: 4-methyl-5-[(4-methylanilino)-oxomethyl]-2-[[oxo(3-pyridinyl)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-5-[(4-methylphenyl)carbamoyl]-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate Traditional Name: 4-methyl-2-nicotinamido-5-(p-tolylcarbamoyl)thiophene-3-carboxylic acid ethyl ester Formula: C22H21N3O4S MolecularWeight: 423.48484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=C(C=C2)C)NC(=O)C3=CN=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=C(C=C2)C)NC(=O)C3=CN=CC=C3

InChI

InChI=1S/C22H21N3O4S/c1-4-29-22(28)17-14(3)18(20(27)24-16-9-7-13(2)8-10-16)30-21(17)25-19(26)15-6-5-11-23-12-15/h5-12H,4H2,1-3H3,(H,24,27)(H,25,26)