1-(2,5-dimethoxyphenyl)-2-[2-(phenoxymethyl)quinazolin-4-yl]sulfanyl-ethanone

Systemtic Name: 1-(2,5-dimethoxyphenyl)-2-[2-(phenoxymethyl)quinazolin-4-yl]sulfanyl-ethanone Openeye Name: 1-(2,5-dimethoxyphenyl)-2-[2-(phenoxymethyl)quinazolin-4-yl]sulfanyl-ethanone CAS Name: 1-(2,5-dimethoxyphenyl)-2-[[2-(phenoxymethyl)-4-quinazolinyl]thio]ethanone IUPAC Name: 1-(2,5-dimethoxyphenyl)-2-[2-(phenoxymethyl)quinazolin-4-yl]sulfanylethanone Traditional Name: 1-(2,5-dimethoxyphenyl)-2-[[2-(phenoxymethyl)quinazolin-4-yl]thio]ethanone Formula: C25H22N2O4S MolecularWeight: 446.51818

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(=O)CSC2=NC(=NC3=CC=CC=C32)COC4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C(=O)CSC2=NC(=NC3=CC=CC=C32)COC4=CC=CC=C4

InChI

InChI=1S/C25H22N2O4S/c1-29-18-12-13-23(30-2)20(14-18)22(28)16-32-25-19-10-6-7-11-21(19)26-24(27-25)15-31-17-8-4-3-5-9-17/h3-14H,15-16H2,1-2H3