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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N2C(=N1)N=CN2)C3=CC=CC=[NH+]3)C(=O)NC4=CN=CC=C4

Isomeric SMILES

CC1=C(C(N2C(=N1)N=CN2)C3=CC=CC=[NH+]3)C(=O)NC4=CN=CC=C4

InChI

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