1,2-bis(benzotriazol-1-yl)-N-(2-bromophenyl)-N'-(4-methylphenyl)ethane-1,2-diimine

Systemtic Name: 1,2-bis(benzotriazol-1-yl)-N-(2-bromophenyl)-N'-(4-methylphenyl)ethane-1,2-diimine Openeye Name: 1,2-bis(benzotriazol-1-yl)-N-(2-bromophenyl)-N'-(p-tolyl)ethane-1,2-diimine CAS Name: 1,2-bis(1-benzotriazolyl)-N-(2-bromophenyl)-N'-(4-methylphenyl)ethane-1,2-diimine IUPAC Name: 1,2-bis(benzotriazol-1-yl)-N-(2-bromophenyl)-N'-(4-methylphenyl)ethane-1,2-diimine Traditional Name: [1,2-bis(benzotriazol-1-yl)-2-(2-bromophenyl)imino-ethylidene]-(p-tolyl)amine Formula: C27H19BrN8 MolecularWeight: 535.39736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N=C(C(=NC2=CC=CC=C2Br)N3C4=CC=CC=C4N=N3)N5C6=CC=CC=C6N=N5

Isomeric SMILES

CC1=CC=C(C=C1)N=C(C(=NC2=CC=CC=C2Br)N3C4=CC=CC=C4N=N3)N5C6=CC=CC=C6N=N5

InChI

InChI=1S/C27H19BrN8/c1-18-14-16-19(17-15-18)29-26(35-24-12-6-4-10-22(24)31-33-35)27(30-21-9-3-2-8-20(21)28)36-25-13-7-5-11-23(25)32-34-36/h2-17H,1H3