(2S)-2-(butanoylamino)-4-methylsulfanyl-N-(1,3-thiazol-4-ylmethyl)butanamide

Systemtic Name: (2S)-2-(butanoylamino)-4-methylsulfanyl-N-(1,3-thiazol-4-ylmethyl)butanamide Openeye Name: (2S)-2-(butanoylamino)-4-methylsulfanyl-N-(thiazol-4-ylmethyl)butanamide CAS Name: (2S)-4-(methylthio)-2-(1-oxobutylamino)-N-(4-thiazolylmethyl)butanamide IUPAC Name: (2S)-2-(butanoylamino)-4-methylsulfanyl-N-(1,3-thiazol-4-ylmethyl)butanamide Traditional Name: (2S)-2-butyramido-4-(methylthio)-N-(thiazol-4-ylmethyl)butyramide Formula: C13H21N3O2S2 MolecularWeight: 315.45474

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC(CCSC)C(=O)NCC1=CSC=N1

Isomeric SMILES

CCCC(=O)N[C@@H](CCSC)C(=O)NCC1=CSC=N1

InChI

InChI=1S/C13H21N3O2S2/c1-3-4-12(17)16-11(5-6-19-2)13(18)14-7-10-8-20-9-15-10/h8-9,11H,3-7H2,1-2H3,(H,14,18)(H,16,17)/t11-/m0/s1