2-(3-butoxypyridin-2-yl)-6-(2H-1,2,3,4-tetrazol-5-yl)-1H-quinazolin-4-one

Systemtic Name: 2-(3-butoxypyridin-2-yl)-6-(2H-1,2,3,4-tetrazol-5-yl)-1H-quinazolin-4-one Openeye Name: 2-(3-butoxy-2-pyridyl)-6-(2H-tetrazol-5-yl)-1H-quinazolin-4-one CAS Name: 2-(3-butoxy-2-pyridinyl)-6-(2H-tetrazol-5-yl)-1H-quinazolin-4-one IUPAC Name: 2-(3-butoxypyridin-2-yl)-6-(2H-tetrazol-5-yl)-1H-quinazolin-4-one Traditional Name: 2-(3-butoxy-2-pyridyl)-6-(2H-tetrazol-5-yl)-1H-quinazolin-4-one Formula: C18H17N7O2 MolecularWeight: 363.37328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(N=CC=C1)C2=NC(=O)C3=C(N2)C=CC(=C3)C4=NNN=N4

Isomeric SMILES

CCCCOC1=C(N=CC=C1)C2=NC(=O)C3=C(N2)C=CC(=C3)C4=NNN=N4

InChI

InChI=1S/C18H17N7O2/c1-2-3-9-27-14-5-4-8-19-15(14)17-20-13-7-6-11(16-22-24-25-23-16)10-12(13)18(26)21-17/h4-8,10H,2-3,9H2,1H3,(H,20,21,26)(H,22,23,24,25)