5-(2-methylsulfanylpyridin-3-yl)carbonyl-3-[(4-nitrophenyl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxamide

Systemtic Name: 5-(2-methylsulfanylpyridin-3-yl)carbonyl-3-[(4-nitrophenyl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxamide Openeye Name: 5-(2-methylsulfanylpyridine-3-carbonyl)-3-[(4-nitrophenyl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxamide CAS Name: 5-[[2-(methylthio)-3-pyridinyl]-oxomethyl]-3-[(4-nitrophenyl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxamide IUPAC Name: 5-(2-methylsulfanylpyridine-3-carbonyl)-3-[(4-nitrophenyl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxamide Traditional Name: 5-[2-(methylthio)nicotinoyl]-3-(4-nitrobenzyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxamide Formula: C21H20N6O4S MolecularWeight: 452.4863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)N2CC3=C(CC2C(=O)N)N=CN3CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)N2CC3=C(CC2C(=O)N)N=CN3CC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H20N6O4S/c1-32-20-15(3-2-8-23-20)21(29)26-11-18-16(9-17(26)19(22)28)24-12-25(18)10-13-4-6-14(7-5-13)27(30)31/h2-8,12,17H,9-11H2,1H3,(H2,22,28)