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

Systemtic Name: 5-methyl-N-phenyl-7-pyridin-1-ium-2-yl-1,7-dihydro-[1,2,3,4]tetrazolo[1,5-a]pyrimidine-6-carboxamide Openeye Name: 5-methyl-N-phenyl-7-pyridin-1-ium-2-yl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide CAS Name: 5-methyl-N-phenyl-7-(2-pyridin-1-iumyl)-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide IUPAC Name: 5-methyl-N-phenyl-7-pyridin-1-ium-2-yl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide Traditional Name: 5-methyl-N-phenyl-7-pyridin-1-ium-2-yl-1,7-dihydrotetrazolo[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=NN2)C3=CC=CC=[NH+]3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(N2C(=N1)N=NN2)C3=CC=CC=[NH+]3)C(=O)NC4=CC=CC=C4

InChI

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