5-methyl-N-pyridin-3-yl-7-pyridin-4-yl-4,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidin-8-ium-6-carboxamide

Systemtic Name: 5-methyl-N-pyridin-3-yl-7-pyridin-4-yl-4,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidin-8-ium-6-carboxamide Openeye Name: 5-methyl-N-(3-pyridyl)-7-(4-pyridyl)-4,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidin-8-ium-6-carboxamide CAS Name: 5-methyl-N-(3-pyridinyl)-7-pyridin-4-yl-4,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidin-8-ium-6-carboxamide IUPAC Name: 5-methyl-N-pyridin-3-yl-7-pyridin-4-yl-4,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidin-8-ium-6-carboxamide Traditional Name: 5-methyl-N-(3-pyridyl)-7-(4-pyridyl)-4,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidin-8-ium-6-carboxamide Formula: C17H16N7O+ MolecularWeight: 334.35524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C([N+]2=C(N1)N=CN2)C3=CC=NC=C3)C(=O)NC4=CN=CC=C4

Isomeric SMILES

CC1=C(C([N+]2=C(N1)N=CN2)C3=CC=NC=C3)C(=O)NC4=CN=CC=C4

InChI

InChI=1S/C17H15N7O/c1-11-14(16(25)23-13-3-2-6-19-9-13)15(12-4-7-18-8-5-12)24-17(22-11)20-10-21-24/h2-10,15H,1H3,(H2,20,21,22,23,25)/p+1