(2S)-2-[[(2S)-2-azanyl-3-phenyl-propanoyl]amino]-4-methylsulfanyl-butanamide hydrochloride

Systemtic Name: (2S)-2-[[(2S)-2-azanyl-3-phenyl-propanoyl]amino]-4-methylsulfanyl-butanamide hydrochloride Openeye Name: (2S)-2-[[(2S)-2-amino-3-phenyl-propanoyl]amino]-4-methylsulfanyl-butanamide hydrochloride CAS Name: (2S)-2-[[(2S)-2-amino-1-oxo-3-phenylpropyl]amino]-4-(methylthio)butanamide hydrochloride IUPAC Name: (2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-4-methylsulfanylbutanamide hydrochloride Traditional Name: (2S)-2-[[(2S)-2-amino-3-phenyl-propanoyl]amino]-4-(methylthio)butyramide hydrochloride Formula: C14H22ClN3O2S MolecularWeight: 331.86138

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N)NC(=O)C(CC1=CC=CC=C1)N.Cl

Isomeric SMILES

CSCC[C@@H](C(=O)N)NC(=O)[C@H](CC1=CC=CC=C1)N.Cl

InChI

InChI=1S/C14H21N3O2S.ClH/c1-20-8-7-12(13(16)18)17-14(19)11(15)9-10-5-3-2-4-6-10;/h2-6,11-12H,7-9,15H2,1H3,(H2,16,18)(H,17,19);1H/t11-,12-;/m0./s1