4,6-dimethyl-2-[2-(4-nitrophenyl)-2-oxidanylidene-ethyl]sulfanyl-N-phenyl-pyridine-3-carboxamide

Systemtic Name: 4,6-dimethyl-2-[2-(4-nitrophenyl)-2-oxidanylidene-ethyl]sulfanyl-N-phenyl-pyridine-3-carboxamide Openeye Name: 4,6-dimethyl-2-[2-(4-nitrophenyl)-2-oxo-ethyl]sulfanyl-N-phenyl-pyridine-3-carboxamide CAS Name: 4,6-dimethyl-2-[[2-(4-nitrophenyl)-2-oxoethyl]thio]-N-phenyl-3-pyridinecarboxamide IUPAC Name: 4,6-dimethyl-2-[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl-N-phenylpyridine-3-carboxamide Traditional Name: 2-[[2-keto-2-(4-nitrophenyl)ethyl]thio]-4,6-dimethyl-N-phenyl-nicotinamide Formula: C22H19N3O4S MolecularWeight: 421.46896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C(=O)NC2=CC=CC=C2)SCC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NC(=C1C(=O)NC2=CC=CC=C2)SCC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C22H19N3O4S/c1-14-12-15(2)23-22(20(14)21(27)24-17-6-4-3-5-7-17)30-13-19(26)16-8-10-18(11-9-16)25(28)29/h3-12H,13H2,1-2H3,(H,24,27)