7-(2-chlorophenyl)-5-pyridin-3-yl-4,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidin-8-ium

Systemtic Name: 7-(2-chlorophenyl)-5-pyridin-3-yl-4,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidin-8-ium Openeye Name: 7-(2-chlorophenyl)-5-(3-pyridyl)-4,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidin-8-ium CAS Name: 7-(2-chlorophenyl)-5-(3-pyridinyl)-4,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidin-8-ium IUPAC Name: 7-(2-chlorophenyl)-5-pyridin-3-yl-4,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidin-8-ium Traditional Name: 7-(2-chlorophenyl)-5-(3-pyridyl)-4,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidin-8-ium Formula: C16H13ClN5+ MolecularWeight: 310.76092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2C=C(NC3=[N+]2NC=N3)C4=CN=CC=C4)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C2C=C(NC3=[N+]2NC=N3)C4=CN=CC=C4)Cl

InChI

InChI=1S/C16H12ClN5/c17-13-6-2-1-5-12(13)15-8-14(11-4-3-7-18-9-11)21-16-19-10-20-22(15)16/h1-10,15H,(H,19,20,21)/p+1