2-[2-[(2-methoxy-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide

Systemtic Name: 2-[2-[(2-methoxy-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide Openeye Name: 2-[2-(2-methoxy-5-nitro-anilino)-2-oxo-ethyl]sulfanyl-N-(5-methylisoxazol-3-yl)propanamide CAS Name: 2-[[2-(2-methoxy-5-nitroanilino)-2-oxoethyl]thio]-N-(5-methyl-3-isoxazolyl)propanamide IUPAC Name: 2-[2-(2-methoxy-5-nitroanilino)-2-oxoethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide Traditional Name: 2-[[2-keto-2-(2-methoxy-5-nitro-anilino)ethyl]thio]-N-(5-methylisoxazol-3-yl)propionamide Formula: C16H18N4O6S MolecularWeight: 394.40232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C16H18N4O6S/c1-9-6-14(19-26-9)18-16(22)10(2)27-8-15(21)17-12-7-11(20(23)24)4-5-13(12)25-3/h4-7,10H,8H2,1-3H3,(H,17,21)(H,18,19,22)