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

Systemtic Name: N-[2-azanyl-3-(4-methoxyphenyl)propanoyl]-N-methyl-2-(2-methylpropyl)-N'-oxidanyl-3-(sulfanylmethyl)butanediamide Openeye Name: N-[2-amino-3-(4-methoxyphenyl)propanoyl]-2-[2-(hydroxyamino)-2-oxo-1-(sulfanylmethyl)ethyl]-N,4-dimethyl-pentanamide CAS Name: N-[2-amino-3-(4-methoxyphenyl)-1-oxopropyl]-N'-hydroxy-3-(mercaptomethyl)-N-methyl-2-(2-methylpropyl)butanediamide IUPAC Name: N-[2-amino-3-(4-methoxyphenyl)propanoyl]-N'-hydroxy-N-methyl-2-(2-methylpropyl)-3-(sulfanylmethyl)butanediamide Traditional Name: N-[2-amino-3-(4-methoxyphenyl)propanoyl]-2-[2-(hydroxyamino)-2-keto-1-(mercaptomethyl)ethyl]-N,4-dimethyl-valeramide Formula: C20H31N3O5S MolecularWeight: 425.54224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H31N3O5S/c1-12(2)9-15(16(11-29)18(24)22-27)19(25)23(3)20(26)17(21)10-13-5-7-14(28-4)8-6-13/h5-8,12,15-17,27,29H,9-11,21H2,1-4H3,(H,22,24)