2H-benzotriazol-5-yl N-[6-[[5-(2H-benzotriazol-5-yloxymethylamino)-1-oxidanidyl-pyridin-1-ium-2-yl]disulfanyl]-1-oxidanidyl-pyridin-1-ium-3-yl]methanimidate

Systemtic Name: 2H-benzotriazol-5-yl N-[6-[[5-(2H-benzotriazol-5-yloxymethylamino)-1-oxidanidyl-pyridin-1-ium-2-yl]disulfanyl]-1-oxidanidyl-pyridin-1-ium-3-yl]methanimidate Openeye Name: 2H-benzotriazol-5-yl N-[6-[[5-(2H-benzotriazol-5-yloxymethylamino)-1-oxido-pyridin-1-ium-2-yl]disulfanyl]-1-oxido-pyridin-1-ium-3-yl]methanimidate CAS Name: N-[6-[[5-(2H-benzotriazol-5-yloxymethylamino)-1-oxido-2-pyridin-1-iumyl]disulfanyl]-1-oxido-3-pyridin-1-iumyl]methanimidic acid 2H-benzotriazol-5-yl ester IUPAC Name: 2H-benzotriazol-5-yl N-[6-[[5-(2H-benzotriazol-5-yloxymethylamino)-1-oxidopyridin-1-ium-2-yl]disulfanyl]-1-oxidopyridin-1-ium-3-yl]methanimidate Traditional Name: N-[6-[[5-(2H-benzotriazol-5-yloxymethylamino)-1-oxido-pyridin-1-ium-2-yl]disulfanyl]-1-oxido-pyridin-1-ium-3-yl]formimidic acid 2H-benzotriazol-5-yl ester Formula: C24H18N10O4S2 MolecularWeight: 574.59432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NNN=C2C=C1OCNC3=C[N+](=C(C=C3)SSC4=[N+](C=C(C=C4)N=COC5=CC6=NNN=C6C=C5)[O-])[O-]

Isomeric SMILES

C1=CC2=NNN=C2C=C1OCNC3=C[N+](=C(C=C3)SSC4=[N+](C=C(C=C4)N=COC5=CC6=NNN=C6C=C5)[O-])[O-]

InChI

InChI=1S/C24H18N10O4S2/c35-33-11-15(25-13-37-17-3-5-19-21(9-17)29-31-27-19)1-7-23(33)39-40-24-8-2-16(12-34(24)36)26-14-38-18-4-6-20-22(10-18)30-32-28-20/h1-13,26H,14H2,(H,27,29,31)(H,28,30,32)