bis(benzotriazol-1-ylmethyl)-[2-(benzotriazol-1-ylmethylsulfanyl)ethyl]azanium

Systemtic Name: bis(benzotriazol-1-ylmethyl)-[2-(benzotriazol-1-ylmethylsulfanyl)ethyl]azanium Openeye Name: bis(benzotriazol-1-ylmethyl)-[2-(benzotriazol-1-ylmethylsulfanyl)ethyl]ammonium CAS Name: bis(1-benzotriazolylmethyl)-[2-(1-benzotriazolylmethylthio)ethyl]ammonium IUPAC Name: bis(benzotriazol-1-ylmethyl)-[2-(benzotriazol-1-ylmethylsulfanyl)ethyl]azanium Traditional Name: bis(benzotriazol-1-ylmethyl)-[2-(benzotriazol-1-ylmethylthio)ethyl]ammonium Formula: C23H23N10S+ MolecularWeight: 471.56072

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2C[NH+](CCSCN3C4=CC=CC=C4N=N3)CN5C6=CC=CC=C6N=N5

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2C[NH+](CCSCN3C4=CC=CC=C4N=N3)CN5C6=CC=CC=C6N=N5

InChI

InChI=1S/C23H22N10S/c1-4-10-21-18(7-1)24-27-31(21)15-30(16-32-22-11-5-2-8-19(22)25-28-32)13-14-34-17-33-23-12-6-3-9-20(23)26-29-33/h1-12H,13-17H2/p+1