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

Systemtic Name: 5-methyl-7-pyridin-1-ium-3-yl-1,7-dihydro-[1,2,3,4]tetrazolo[1,5-a]pyrimidine-6-carboxamide Openeye Name: 5-methyl-7-pyridin-1-ium-3-yl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide CAS Name: 5-methyl-7-(3-pyridin-1-iumyl)-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide IUPAC Name: 5-methyl-7-pyridin-1-ium-3-yl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide Traditional Name: 5-methyl-7-pyridin-1-ium-3-yl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide Formula: C11H12N7O+ MolecularWeight: 258.25928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11N7O/c1-6-8(10(12)19)9(7-3-2-4-13-5-7)18-11(14-6)15-16-17-18/h2-5,9H,1H3,(H2,12,19)(H,14,15,17)/p+1