methyl [5-cyano-4-(2-nitrophenyl)-2-oxidanylidene-3,4-dihydro-1H-pyridin-6-yl]methylsulfanylmethanoate

Systemtic Name: methyl [5-cyano-4-(2-nitrophenyl)-2-oxidanylidene-3,4-dihydro-1H-pyridin-6-yl]methylsulfanylmethanoate Openeye Name: methyl [5-cyano-4-(2-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]methylsulfanylformate CAS Name: [[5-cyano-4-(2-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]methylthio]formic acid methyl ester IUPAC Name: methyl [5-cyano-4-(2-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]methylsulfanylformate Traditional Name: [[5-cyano-2-keto-4-(2-nitrophenyl)-3,4-dihydro-1H-pyridin-6-yl]methylthio]formic acid methyl ester Formula: C15H13N3O5S MolecularWeight: 347.34582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)SCC1=C(C(CC(=O)N1)C2=CC=CC=C2[N+](=O)[O-])C#N

Isomeric SMILES

COC(=O)SCC1=C(C(CC(=O)N1)C2=CC=CC=C2[N+](=O)[O-])C#N

InChI

InChI=1S/C15H13N3O5S/c1-23-15(20)24-8-12-11(7-16)10(6-14(19)17-12)9-4-2-3-5-13(9)18(21)22/h2-5,10H,6,8H2,1H3,(H,17,19)