ethyl 2-[(4,6-dimethylpyridin-2-yl)carbonylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(4,6-dimethylpyridin-2-yl)carbonylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(4,6-dimethylpyridine-2-carbonyl)amino]-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[(4,6-dimethyl-2-pyridinyl)-oxomethyl]amino]-5-methyl-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4,6-dimethylpyridine-2-carbonyl)amino]-5-methyl-4-phenylthiophene-3-carboxylate Traditional Name: 2-[(4,6-dimethylpicolinoyl)amino]-5-methyl-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=O)C3=NC(=CC(=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=O)C3=NC(=CC(=C3)C)C

InChI

InChI=1S/C22H22N2O3S/c1-5-27-22(26)19-18(16-9-7-6-8-10-16)15(4)28-21(19)24-20(25)17-12-13(2)11-14(3)23-17/h6-12H,5H2,1-4H3,(H,24,25)