N-[2-azanyl-3-(4-methoxyphenyl)propanoyl]-N-methyl-2-(2-methylpropyl)-3-(methylsulfanylmethyl)-N'-oxidanyl-butanediamide

Systemtic Name: N-[2-azanyl-3-(4-methoxyphenyl)propanoyl]-N-methyl-2-(2-methylpropyl)-3-(methylsulfanylmethyl)-N'-oxidanyl-butanediamide Openeye Name: N-[2-amino-3-(4-methoxyphenyl)propanoyl]-2-[2-(hydroxyamino)-1-(methylsulfanylmethyl)-2-oxo-ethyl]-N,4-dimethyl-pentanamide CAS Name: N-[2-amino-3-(4-methoxyphenyl)-1-oxopropyl]-N'-hydroxy-N-methyl-2-(2-methylpropyl)-3-[(methylthio)methyl]butanediamide IUPAC Name: N-[2-amino-3-(4-methoxyphenyl)propanoyl]-N'-hydroxy-N-methyl-2-(2-methylpropyl)-3-(methylsulfanylmethyl)butanediamide Traditional Name: N-[2-amino-3-(4-methoxyphenyl)propanoyl]-2-[2-(hydroxyamino)-2-keto-1-[(methylthio)methyl]ethyl]-N,4-dimethyl-valeramide Formula: C21H33N3O5S MolecularWeight: 439.56882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(CSC)C(=O)NO)C(=O)N(C)C(=O)C(CC1=CC=C(C=C1)OC)N

Isomeric SMILES

CC(C)CC(C(CSC)C(=O)NO)C(=O)N(C)C(=O)C(CC1=CC=C(C=C1)OC)N

InChI

InChI=1S/C21H33N3O5S/c1-13(2)10-16(17(12-30-5)19(25)23-28)20(26)24(3)21(27)18(22)11-14-6-8-15(29-4)9-7-14/h6-9,13,16-18,28H,10-12,22H2,1-5H3,(H,23,25)