N-methyl-2-(3-methylbutyl)-N'-[(2-methyl-2-sulfanyl-propyl)carbamoyl]-N',2-bis(oxidanyl)propanediamide

Systemtic Name: N-methyl-2-(3-methylbutyl)-N'-[(2-methyl-2-sulfanyl-propyl)carbamoyl]-N',2-bis(oxidanyl)propanediamide Openeye Name: N,2-dihydroxy-2-isopentyl-N'-methyl-N-[(2-methyl-2-sulfanyl-propyl)carbamoyl]propanediamide CAS Name: N,2-dihydroxy-N-[[(2-mercapto-2-methylpropyl)amino]-oxomethyl]-N'-methyl-2-(3-methylbutyl)propanediamide IUPAC Name: N,2-dihydroxy-N'-methyl-2-(3-methylbutyl)-N-[(2-methyl-2-sulfanylpropyl)carbamoyl]propanediamide Traditional Name: N,2-dihydroxy-2-isoamyl-N-[(2-mercapto-2-methyl-propyl)carbamoyl]-N'-methyl-malonamide Formula: C14H27N3O5S MolecularWeight: 349.44628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C(=O)NC)(C(=O)N(C(=O)NCC(C)(C)S)O)O

Isomeric SMILES

CC(C)CCC(C(=O)NC)(C(=O)N(C(=O)NCC(C)(C)S)O)O

InChI

InChI=1S/C14H27N3O5S/c1-9(2)6-7-14(21,10(18)15-5)11(19)17(22)12(20)16-8-13(3,4)23/h9,21-23H,6-8H2,1-5H3,(H,15,18)(H,16,20)