(2S)-N'-[(2S)-3-methyl-1-(methylamino)-1-sulfanylidene-butan-2-yl]-2-propyl-butanediamide

Systemtic Name: (2S)-N'-[(2S)-3-methyl-1-(methylamino)-1-sulfanylidene-butan-2-yl]-2-propyl-butanediamide Openeye Name: (2S)-N'-[(1S)-2-methyl-1-(methylcarbamothioyl)propyl]-2-propyl-butanediamide CAS Name: (2S)-N'-[(2S)-3-methyl-1-(methylamino)-1-sulfanylidenebutan-2-yl]-2-propylbutanediamide IUPAC Name: (2S)-N'-[(2S)-3-methyl-1-(methylamino)-1-sulfanylidenebutan-2-yl]-2-propylbutanediamide Traditional Name: (2S)-N'-[(1S)-2-methyl-1-(methylthiocarbamoyl)propyl]-2-propyl-succinamide Formula: C13H25N3O2S MolecularWeight: 287.4215

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC(=O)NC(C(C)C)C(=S)NC)C(=O)N

Isomeric SMILES

CCC[C@@H](CC(=O)N[C@@H](C(C)C)C(=S)NC)C(=O)N

InChI

InChI=1S/C13H25N3O2S/c1-5-6-9(12(14)18)7-10(17)16-11(8(2)3)13(19)15-4/h8-9,11H,5-7H2,1-4H3,(H2,14,18)(H,15,19)(H,16,17)/t9-,11-/m0/s1