ethyl 4-cyano-3-methyl-5-(pyridin-4-ylcarbonylamino)thiophene-2-carboxylate

Systemtic Name: ethyl 4-cyano-3-methyl-5-(pyridin-4-ylcarbonylamino)thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-3-methyl-5-(pyridine-4-carbonylamino)thiophene-2-carboxylate CAS Name: 4-cyano-3-methyl-5-[[oxo(pyridin-4-yl)methyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-3-methyl-5-(pyridine-4-carbonylamino)thiophene-2-carboxylate Traditional Name: 4-cyano-5-isonicotinamido-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C15H13N3O3S MolecularWeight: 315.34702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=CC=NC=C2)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=CC=NC=C2)C#N)C

InChI

InChI=1S/C15H13N3O3S/c1-3-21-15(20)12-9(2)11(8-16)14(22-12)18-13(19)10-4-6-17-7-5-10/h4-7H,3H2,1-2H3,(H,18,19)