N-[4-methyl-1-[(4-nitrophenyl)amino]-1-oxidanylidene-pentan-2-yl]-2-(2-methylsulfanylethyl)-N'-oxidanyl-propanediamide

Systemtic Name: N-[4-methyl-1-[(4-nitrophenyl)amino]-1-oxidanylidene-pentan-2-yl]-2-(2-methylsulfanylethyl)-N'-oxidanyl-propanediamide Openeye Name: 2-[[2-(hydroxycarbamoyl)-4-methylsulfanyl-butanoyl]amino]-4-methyl-N-(4-nitrophenyl)pentanamide CAS Name: N-hydroxy-N'-[4-methyl-1-(4-nitroanilino)-1-oxopentan-2-yl]-2-[2-(methylthio)ethyl]propanediamide IUPAC Name: N-hydroxy-N'-[4-methyl-1-(4-nitroanilino)-1-oxopentan-2-yl]-2-(2-methylsulfanylethyl)propanediamide Traditional Name: 2-[[2-(hydroxycarbamoyl)-4-(methylthio)butanoyl]amino]-4-methyl-N-(4-nitrophenyl)valeramide Formula: C18H26N4O6S MolecularWeight: 426.48724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)C(CCSC)C(=O)NO

Isomeric SMILES

CC(C)CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)C(CCSC)C(=O)NO

InChI

InChI=1S/C18H26N4O6S/c1-11(2)10-15(20-16(23)14(8-9-29-3)17(24)21-26)18(25)19-12-4-6-13(7-5-12)22(27)28/h4-7,11,14-15,26H,8-10H2,1-3H3,(H,19,25)(H,20,23)(H,21,24)