2-[[1-(2-azanylpropanoyl)piperidin-4-yl]carbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[[1-(2-azanylpropanoyl)piperidin-4-yl]carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[[1-(2-aminopropanoyl)piperidine-4-carbonyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[[1-(2-amino-1-oxopropyl)-4-piperidinyl]-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[[1-(2-aminopropanoyl)piperidine-4-carbonyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(1-alanylisonipecotoyl)amino]-4-(methylthio)butyric acid Formula: C14H25N3O4S MolecularWeight: 331.431

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(CC1)C(=O)NC(CCSC)C(=O)O)N

Isomeric SMILES

CC(C(=O)N1CCC(CC1)C(=O)NC(CCSC)C(=O)O)N

InChI

InChI=1S/C14H25N3O4S/c1-9(15)13(19)17-6-3-10(4-7-17)12(18)16-11(14(20)21)5-8-22-2/h9-11H,3-8,15H2,1-2H3,(H,16,18)(H,20,21)