5-azanyl-2-[[2-(2-azanylpropanoylamino)-4-methylsulfanyl-butanoyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[[2-(2-azanylpropanoylamino)-4-methylsulfanyl-butanoyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[[2-(2-aminopropanoylamino)-4-methylsulfanyl-butanoyl]amino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[[2-[(2-amino-1-oxopropyl)amino]-4-(methylthio)-1-oxobutyl]amino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[[2-(2-aminopropanoylamino)-4-methylsulfanylbutanoyl]amino]-5-oxopentanoic acid Traditional Name: 2-[[2-(alanylamino)-4-(methylthio)butanoyl]amino]-5-amino-5-keto-valeric acid Formula: C13H24N4O5S MolecularWeight: 348.41846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H24N4O5S/c1-7(14)11(19)16-8(5-6-23-2)12(20)17-9(13(21)22)3-4-10(15)18/h7-9H,3-6,14H2,1-2H3,(H2,15,18)(H,16,19)(H,17,20)(H,21,22)