5-[bis(azanyl)methylideneamino]-2-[[4-[[5-[bis(azanyl)methylideneamino]-1-oxidanyl-1-oxidanylidene-pentan-2-yl]amino]-6-chloranyl-1,3,5-triazin-2-yl]amino]pentanoic acid

Systemtic Name: 5-[bis(azanyl)methylideneamino]-2-[[4-[[5-[bis(azanyl)methylideneamino]-1-oxidanyl-1-oxidanylidene-pentan-2-yl]amino]-6-chloranyl-1,3,5-triazin-2-yl]amino]pentanoic acid Openeye Name: 2-[[4-[(1-carboxy-4-guanidino-butyl)amino]-6-chloro-1,3,5-triazin-2-yl]amino]-5-guanidino-pentanoic acid CAS Name: 2-[[4-chloro-6-[[5-(diaminomethylideneamino)-1-hydroxy-1-oxopentan-2-yl]amino]-1,3,5-triazin-2-yl]amino]-5-(diaminomethylideneamino)pentanoic acid IUPAC Name: 2-[[4-chloro-6-[[5-(diaminomethylideneamino)-1-hydroxy-1-oxopentan-2-yl]amino]-1,3,5-triazin-2-yl]amino]-5-(diaminomethylideneamino)pentanoic acid Traditional Name: 2-[[4-[(1-carboxy-4-guanidino-butyl)amino]-6-chloro-s-triazin-2-yl]amino]-5-guanidino-valeric acid Formula: C15H26ClN11O4 MolecularWeight: 459.89124

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(C(=O)O)NC1=NC(=NC(=N1)Cl)NC(CCCN=C(N)N)C(=O)O)CN=C(N)N

Isomeric SMILES

C(CC(C(=O)O)NC1=NC(=NC(=N1)Cl)NC(CCCN=C(N)N)C(=O)O)CN=C(N)N

InChI

InChI=1S/C15H26ClN11O4/c16-11-25-14(23-7(9(28)29)3-1-5-21-12(17)18)27-15(26-11)24-8(10(30)31)4-2-6-22-13(19)20/h7-8H,1-6H2,(H,28,29)(H,30,31)(H4,17,18,21)(H4,19,20,22)(H2,23,24,25,26,27)