(2S)-2-(3-imidazol-1-ylpropanoylamino)-4-methylsulfanyl-butanoic acid

Systemtic Name: (2S)-2-(3-imidazol-1-ylpropanoylamino)-4-methylsulfanyl-butanoic acid Openeye Name: (2S)-2-(3-imidazol-1-ylpropanoylamino)-4-methylsulfanyl-butanoic acid CAS Name: (2S)-2-[[3-(1-imidazolyl)-1-oxopropyl]amino]-4-(methylthio)butanoic acid IUPAC Name: (2S)-2-(3-imidazol-1-ylpropanoylamino)-4-methylsulfanylbutanoic acid Traditional Name: (2S)-2-(3-imidazol-1-ylpropanoylamino)-4-(methylthio)butyric acid Formula: C11H17N3O3S MolecularWeight: 271.33598

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC(=O)CCN1C=CN=C1

Isomeric SMILES

CSCC[C@@H](C(=O)O)NC(=O)CCN1C=CN=C1

InChI

InChI=1S/C11H17N3O3S/c1-18-7-3-9(11(16)17)13-10(15)2-5-14-6-4-12-8-14/h4,6,8-9H,2-3,5,7H2,1H3,(H,13,15)(H,16,17)/t9-/m0/s1