2-[2-[(4-methyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-pyridin-2-yl-pentanamide

Systemtic Name: 2-[2-[(4-methyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-pyridin-2-yl-pentanamide Openeye Name: 2-[2-(4-methyl-2-nitro-anilino)-2-oxo-ethyl]sulfanyl-N-(2-pyridyl)pentanamide CAS Name: 2-[[2-(4-methyl-2-nitroanilino)-2-oxoethyl]thio]-N-(2-pyridinyl)pentanamide IUPAC Name: 2-[2-(4-methyl-2-nitroanilino)-2-oxoethyl]sulfanyl-N-pyridin-2-ylpentanamide Traditional Name: 2-[[2-keto-2-(4-methyl-2-nitro-anilino)ethyl]thio]-N-(2-pyridyl)valeramide Formula: C19H22N4O4S MolecularWeight: 402.46738

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC1=CC=CC=N1)SCC(=O)NC2=C(C=C(C=C2)C)[N+](=O)[O-]

Isomeric SMILES

CCCC(C(=O)NC1=CC=CC=N1)SCC(=O)NC2=C(C=C(C=C2)C)[N+](=O)[O-]

InChI

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