2-acetamido-4-methylsulfanyl-butanoic acid; 2-azanyl-5-[bis(azanyl)methylideneamino]pentanoic acid

Systemtic Name: 2-acetamido-4-methylsulfanyl-butanoic acid; 2-azanyl-5-[bis(azanyl)methylideneamino]pentanoic acid Openeye Name: 2-acetamido-4-methylsulfanyl-butanoic acid; 2-amino-5-guanidino-pentanoic acid CAS Name: 2-acetamido-4-(methylthio)butanoic acid; 2-amino-5-(diaminomethylideneamino)pentanoic acid IUPAC Name: 2-acetamido-4-methylsulfanylbutanoic acid; 2-amino-5-(diaminomethylideneamino)pentanoic acid Traditional Name: 2-acetamido-4-(methylthio)butyric acid; 2-amino-5-guanidino-valeric acid Formula: C13H27N5O5S MolecularWeight: 365.44898

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCSC)C(=O)O.C(CC(C(=O)O)N)CN=C(N)N

Isomeric SMILES

CC(=O)NC(CCSC)C(=O)O.C(CC(C(=O)O)N)CN=C(N)N

InChI

InChI=1S/C7H13NO3S.C6H14N4O2/c1-5(9)8-6(7(10)11)3-4-12-2;7-4(5(11)12)2-1-3-10-6(8)9/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11);4H,1-3,7H2,(H,11,12)(H4,8,9,10)