6,7-dimethoxy-2-[[1-(2-methoxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 6,7-dimethoxy-2-[[1-(2-methoxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 6,7-dimethoxy-2-[[1-(2-methoxyphenyl)tetrazol-5-yl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 6,7-dimethoxy-2-[[[1-(2-methoxyphenyl)-5-tetrazolyl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 6,7-dimethoxy-2-[[1-(2-methoxyphenyl)tetrazol-5-yl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 6,7-dimethoxy-2-[[[1-(2-methoxyphenyl)tetrazol-5-yl]thio]methyl]-1H-quinazolin-4-one Formula: C19H18N6O4S MolecularWeight: 426.44902

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=NN=N2)SCC3=NC(=O)C4=CC(=C(C=C4N3)OC)OC

Isomeric SMILES

COC1=CC=CC=C1N2C(=NN=N2)SCC3=NC(=O)C4=CC(=C(C=C4N3)OC)OC

InChI

InChI=1S/C19H18N6O4S/c1-27-14-7-5-4-6-13(14)25-19(22-23-24-25)30-10-17-20-12-9-16(29-3)15(28-2)8-11(12)18(26)21-17/h4-9H,10H2,1-3H3,(H,20,21,26)