3-methyl-2-[2-[(4-methylpyridin-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(2-nitrophenyl)butanamide

Systemtic Name: 3-methyl-2-[2-[(4-methylpyridin-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(2-nitrophenyl)butanamide Openeye Name: 3-methyl-2-[2-[(4-methyl-2-pyridyl)amino]-2-oxo-ethyl]sulfanyl-N-(2-nitrophenyl)butanamide CAS Name: 3-methyl-2-[[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]thio]-N-(2-nitrophenyl)butanamide IUPAC Name: 3-methyl-2-[2-[(4-methylpyridin-2-yl)amino]-2-oxoethyl]sulfanyl-N-(2-nitrophenyl)butanamide Traditional Name: 2-[[2-keto-2-[(4-methyl-2-pyridyl)amino]ethyl]thio]-3-methyl-N-(2-nitrophenyl)butyramide Formula: C19H22N4O4S MolecularWeight: 402.46738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)NC(=O)CSC(C(C)C)C(=O)NC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NC=C1)NC(=O)CSC(C(C)C)C(=O)NC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O4S/c1-12(2)18(19(25)21-14-6-4-5-7-15(14)23(26)27)28-11-17(24)22-16-10-13(3)8-9-20-16/h4-10,12,18H,11H2,1-3H3,(H,21,25)(H,20,22,24)