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

Systemtic Name: 2-azanyl-5-[bis(azanyl)methylideneamino]pentanoic acid; 2-azanyl-4-methylsulfanyl-butanoic acid Openeye Name: 2-amino-5-guanidino-pentanoic acid; 2-amino-4-methylsulfanyl-butanoic acid CAS Name: 2-amino-5-(diaminomethylideneamino)pentanoic acid; 2-amino-4-(methylthio)butanoic acid IUPAC Name: 2-amino-5-(diaminomethylideneamino)pentanoic acid; 2-amino-4-methylsulfanylbutanoic acid Traditional Name: 2-amino-5-guanidino-valeric acid; 2-amino-4-(methylthio)butyric acid Formula: C16H36N6O6S2 MolecularWeight: 472.62364

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)N.CSCCC(C(=O)O)N.C(CC(C(=O)O)N)CN=C(N)N

Isomeric SMILES

CSCCC(C(=O)O)N.CSCCC(C(=O)O)N.C(CC(C(=O)O)N)CN=C(N)N

InChI

InChI=1S/C6H14N4O2.2C5H11NO2S/c7-4(5(11)12)2-1-3-10-6(8)9;2*1-9-3-2-4(6)5(7)8/h4H,1-3,7H2,(H,11,12)(H4,8,9,10);2*4H,2-3,6H2,1H3,(H,7,8)