N-(benzotriazol-1-ylmethyl)-7H-purin-6-amine

Systemtic Name: N-(benzotriazol-1-ylmethyl)-7H-purin-6-amine Openeye Name: N-(benzotriazol-1-ylmethyl)-7H-purin-6-amine CAS Name: N-(1-benzotriazolylmethyl)-7H-purin-6-amine IUPAC Name: N-(benzotriazol-1-ylmethyl)-7H-purin-6-amine Traditional Name: benzotriazol-1-ylmethyl(7H-purin-6-yl)amine Formula: C12H10N8 MolecularWeight: 266.2614

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2CNC3=NC=NC4=C3NC=N4

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2CNC3=NC=NC4=C3NC=N4

InChI

InChI=1S/C12H10N8/c1-2-4-9-8(3-1)18-19-20(9)7-17-12-10-11(14-5-13-10)15-6-16-12/h1-6H,7H2,(H2,13,14,15,16,17)