6-(benzotriazol-1-yl)-N4-(pyridin-3-ylmethyl)pyrimidine-4,5-diamine

Systemtic Name: 6-(benzotriazol-1-yl)-N4-(pyridin-3-ylmethyl)pyrimidine-4,5-diamine Openeye Name: 6-(benzotriazol-1-yl)-N4-(3-pyridylmethyl)pyrimidine-4,5-diamine CAS Name: 6-(1-benzotriazolyl)-N4-(3-pyridinylmethyl)pyrimidine-4,5-diamine IUPAC Name: 6-(benzotriazol-1-yl)-4-N-(pyridin-3-ylmethyl)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-(benzotriazol-1-yl)pyrimidin-4-yl]-(3-pyridylmethyl)amine Formula: C16H14N8 MolecularWeight: 318.33596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2C3=C(C(=NC=N3)NCC4=CN=CC=C4)N

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2C3=C(C(=NC=N3)NCC4=CN=CC=C4)N

InChI

InChI=1S/C16H14N8/c17-14-15(19-9-11-4-3-7-18-8-11)20-10-21-16(14)24-13-6-2-1-5-12(13)22-23-24/h1-8,10H,9,17H2,(H,19,20,21)