2-[[1-[2-(2-azanylpropanoylamino)propanoyl]pyrrolidin-2-yl]carbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[[1-[2-(2-azanylpropanoylamino)propanoyl]pyrrolidin-2-yl]carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[[1-[2-(2-aminopropanoylamino)propanoyl]pyrrolidine-2-carbonyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[[1-[2-[(2-amino-1-oxopropyl)amino]-1-oxopropyl]-2-pyrrolidinyl]-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[[1-[2-(2-aminopropanoylamino)propanoyl]pyrrolidine-2-carbonyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[[1-[2-(alanylamino)propanoyl]prolyl]amino]-4-(methylthio)butyric acid Formula: C16H28N4O5S MolecularWeight: 388.48232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)C(=O)N1CCCC1C(=O)NC(CCSC)C(=O)O)N

Isomeric SMILES

CC(C(=O)NC(C)C(=O)N1CCCC1C(=O)NC(CCSC)C(=O)O)N

InChI

InChI=1S/C16H28N4O5S/c1-9(17)13(21)18-10(2)15(23)20-7-4-5-12(20)14(22)19-11(16(24)25)6-8-26-3/h9-12H,4-8,17H2,1-3H3,(H,18,21)(H,19,22)(H,24,25)