2-[[2-[(2-azanyl-4-methyl-pentanoyl)amino]-4-methylsulfanyl-butanoyl]amino]ethanoic acid

Systemtic Name: 2-[[2-[(2-azanyl-4-methyl-pentanoyl)amino]-4-methylsulfanyl-butanoyl]amino]ethanoic acid Openeye Name: 2-[[2-[(2-amino-4-methyl-pentanoyl)amino]-4-methylsulfanyl-butanoyl]amino]acetic acid CAS Name: 2-[[2-[(2-amino-4-methyl-1-oxopentyl)amino]-4-(methylthio)-1-oxobutyl]amino]acetic acid IUPAC Name: 2-[[2-[(2-amino-4-methylpentanoyl)amino]-4-methylsulfanylbutanoyl]amino]acetic acid Traditional Name: 2-[[2-[(2-amino-4-methyl-pentanoyl)amino]-4-(methylthio)butanoyl]amino]acetic acid Formula: C13H25N3O4S MolecularWeight: 319.4203

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H25N3O4S/c1-8(2)6-9(14)12(19)16-10(4-5-21-3)13(20)15-7-11(17)18/h8-10H,4-7,14H2,1-3H3,(H,15,20)(H,16,19)(H,17,18)