[4-[(E)-(3-cyano-4,6-dimethyl-2-oxidanylidene-pyridin-1-yl)iminomethyl]-2-methoxy-phenyl] thiophene-2-carboxylate

Systemtic Name: [4-[(E)-(3-cyano-4,6-dimethyl-2-oxidanylidene-pyridin-1-yl)iminomethyl]-2-methoxy-phenyl] thiophene-2-carboxylate Openeye Name: [4-[(E)-(3-cyano-4,6-dimethyl-2-oxo-1-pyridyl)iminomethyl]-2-methoxy-phenyl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [4-[(E)-(3-cyano-4,6-dimethyl-2-oxo-1-pyridinyl)iminomethyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-(3-cyano-4,6-dimethyl-2-oxopyridin-1-yl)iminomethyl]-2-methoxyphenyl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [4-[(E)-(3-cyano-2-keto-4,6-dimethyl-1-pyridyl)iminomethyl]-2-methoxy-phenyl] ester Formula: C21H17N3O4S MolecularWeight: 407.44238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)N1N=CC2=CC(=C(C=C2)OC(=O)C3=CC=CS3)OC)C#N)C

Isomeric SMILES

CC1=CC(=C(C(=O)N1/N=C/C2=CC(=C(C=C2)OC(=O)C3=CC=CS3)OC)C#N)C

InChI

InChI=1S/C21H17N3O4S/c1-13-9-14(2)24(20(25)16(13)11-22)23-12-15-6-7-17(18(10-15)27-3)28-21(26)19-5-4-8-29-19/h4-10,12H,1-3H3/b23-12+