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

Systemtic Name: 5-methyl-7-pyridin-1-ium-4-yl-N-pyridin-3-yl-4,7-dihydro-1H-[1,2,3,4]tetrazolo[1,5-a]pyrimidin-8-ium-6-carboxamide Openeye Name: 5-methyl-7-pyridin-1-ium-4-yl-N-(3-pyridyl)-4,7-dihydro-1H-tetrazolo[1,5-a]pyrimidin-8-ium-6-carboxamide CAS Name: 5-methyl-7-(4-pyridin-1-iumyl)-N-(3-pyridinyl)-4,7-dihydro-1H-tetrazolo[1,5-a]pyrimidin-8-ium-6-carboxamide IUPAC Name: 5-methyl-7-pyridin-1-ium-4-yl-N-pyridin-3-yl-4,7-dihydro-1H-tetrazolo[1,5-a]pyrimidin-8-ium-6-carboxamide Traditional Name: 5-methyl-7-pyridin-1-ium-4-yl-N-(3-pyridyl)-4,7-dihydro-1H-tetrazolo[1,5-a]pyrimidin-8-ium-6-carboxamide Formula: C16H16N8O+2 MolecularWeight: 336.35124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C([N+]2=C(N1)N=NN2)C3=CC=[NH+]C=C3)C(=O)NC4=CN=CC=C4

Isomeric SMILES

CC1=C(C([N+]2=C(N1)N=NN2)C3=CC=[NH+]C=C3)C(=O)NC4=CN=CC=C4

InChI

InChI=1S/C16H14N8O/c1-10-13(15(25)20-12-3-2-6-18-9-12)14(11-4-7-17-8-5-11)24-16(19-10)21-22-23-24/h2-9,14H,1H3,(H2,19,20,21,23,25)/p+2