N-(4-chloranyl-3-nitro-phenyl)-2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-chloranyl-3-nitro-phenyl)-2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-chloro-3-nitro-phenyl)-2-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]acetamide CAS Name: N-(4-chloro-3-nitrophenyl)-2-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]acetamide IUPAC Name: N-(4-chloro-3-nitrophenyl)-2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanylacetamide Traditional Name: N-(4-chloro-3-nitro-phenyl)-2-[(3-cyano-4,6-dimethyl-2-pyridyl)thio]acetamide Formula: C16H13ClN4O3S MolecularWeight: 376.81742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13ClN4O3S/c1-9-5-10(2)19-16(12(9)7-18)25-8-15(22)20-11-3-4-13(17)14(6-11)21(23)24/h3-6H,8H2,1-2H3,(H,20,22)