N-methyl-2-(3-methylbutyl)-N'-(2-methylpropylcarbamoyl)-N'-oxidanyl-2-(phenylmethylsulfanyl)propanediamide

Systemtic Name: N-methyl-2-(3-methylbutyl)-N'-(2-methylpropylcarbamoyl)-N'-oxidanyl-2-(phenylmethylsulfanyl)propanediamide Openeye Name: 2-benzylsulfanyl-N-hydroxy-N-(isobutylcarbamoyl)-2-isopentyl-N'-methyl-propanediamide CAS Name: N-hydroxy-N'-methyl-2-(3-methylbutyl)-N-[(2-methylpropylamino)-oxomethyl]-2-(phenylmethylthio)propanediamide IUPAC Name: 2-benzylsulfanyl-N-hydroxy-N'-methyl-2-(3-methylbutyl)-N-(2-methylpropylcarbamoyl)propanediamide Traditional Name: 2-(benzylthio)-N-hydroxy-2-isoamyl-N-(isobutylcarbamoyl)-N'-methyl-malonamide Formula: C21H33N3O4S MolecularWeight: 423.56942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C(=O)NC)(C(=O)N(C(=O)NCC(C)C)O)SCC1=CC=CC=C1

Isomeric SMILES

CC(C)CCC(C(=O)NC)(C(=O)N(C(=O)NCC(C)C)O)SCC1=CC=CC=C1

InChI

InChI=1S/C21H33N3O4S/c1-15(2)11-12-21(18(25)22-5,29-14-17-9-7-6-8-10-17)19(26)24(28)20(27)23-13-16(3)4/h6-10,15-16,28H,11-14H2,1-5H3,(H,22,25)(H,23,27)