2-azanyl-4-methylsulfanyl-N-[2-(phenylmethyl)-3-sulfanyl-propanoyl]butanamide

Systemtic Name: 2-azanyl-4-methylsulfanyl-N-[2-(phenylmethyl)-3-sulfanyl-propanoyl]butanamide Openeye Name: 2-amino-N-(2-benzyl-3-sulfanyl-propanoyl)-4-methylsulfanyl-butanamide CAS Name: 2-amino-N-[2-(mercaptomethyl)-1-oxo-3-phenylpropyl]-4-(methylthio)butanamide IUPAC Name: 2-amino-N-(2-benzyl-3-sulfanylpropanoyl)-4-methylsulfanylbutanamide Traditional Name: 2-amino-N-(2-benzyl-3-mercapto-propanoyl)-4-(methylthio)butyramide Formula: C15H22N2O2S2 MolecularWeight: 326.47738

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC(=O)C(CC1=CC=CC=C1)CS)N

Isomeric SMILES

CSCCC(C(=O)NC(=O)C(CC1=CC=CC=C1)CS)N

InChI

InChI=1S/C15H22N2O2S2/c1-21-8-7-13(16)15(19)17-14(18)12(10-20)9-11-5-3-2-4-6-11/h2-6,12-13,20H,7-10,16H2,1H3,(H,17,18,19)