6,7-dimethoxy-2-phenyl-4-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)quinazoline

Systemtic Name: 6,7-dimethoxy-2-phenyl-4-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)quinazoline Openeye Name: 6,7-dimethoxy-2-phenyl-4-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)quinazoline CAS Name: 6,7-dimethoxy-2-phenyl-4-([1,2,4]triazolo[4,3-a]pyridin-3-ylthio)quinazoline IUPAC Name: 6,7-dimethoxy-2-phenyl-4-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)quinazoline Traditional Name: 6,7-dimethoxy-2-phenyl-4-([1,2,4]triazolo[4,3-a]pyridin-3-ylthio)quinazoline Formula: C22H17N5O2S MolecularWeight: 415.46768

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)C3=CC=CC=C3)SC4=NN=C5N4C=CC=C5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)C3=CC=CC=C3)SC4=NN=C5N4C=CC=C5)OC

InChI

InChI=1S/C22H17N5O2S/c1-28-17-12-15-16(13-18(17)29-2)23-20(14-8-4-3-5-9-14)24-21(15)30-22-26-25-19-10-6-7-11-27(19)22/h3-13H,1-2H3