5-[bis(azanyl)methylideneamino]-2-bromanylsulfanyl-pentanoic acid

Systemtic Name: 5-[bis(azanyl)methylideneamino]-2-bromanylsulfanyl-pentanoic acid Openeye Name: 2-bromosulfanyl-5-guanidino-pentanoic acid CAS Name: 2-(bromothio)-5-(diaminomethylideneamino)pentanoic acid IUPAC Name: 2-bromosulfanyl-5-(diaminomethylideneamino)pentanoic acid Traditional Name: 2-(bromothio)-5-guanidino-valeric acid Formula: C6H12BrN3O2S MolecularWeight: 270.14738

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(C(=O)O)SBr)CN=C(N)N

Isomeric SMILES

C(CC(C(=O)O)SBr)CN=C(N)N

InChI

InChI=1S/C6H12BrN3O2S/c7-13-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3H2,(H,11,12)(H4,8,9,10)