3-(3,4-dimethoxyphenyl)-2-(pyridin-3-ylmethylsulfanyl)quinazolin-4-one

Systemtic Name: 3-(3,4-dimethoxyphenyl)-2-(pyridin-3-ylmethylsulfanyl)quinazolin-4-one Openeye Name: 3-(3,4-dimethoxyphenyl)-2-(3-pyridylmethylsulfanyl)quinazolin-4-one CAS Name: 3-(3,4-dimethoxyphenyl)-2-(3-pyridinylmethylthio)-4-quinazolinone IUPAC Name: 3-(3,4-dimethoxyphenyl)-2-(pyridin-3-ylmethylsulfanyl)quinazolin-4-one Traditional Name: 3-(3,4-dimethoxyphenyl)-2-(3-pyridylmethylthio)quinazolin-4-one Formula: C22H19N3O3S MolecularWeight: 405.46956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CN=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CN=CC=C4)OC

InChI

InChI=1S/C22H19N3O3S/c1-27-19-10-9-16(12-20(19)28-2)25-21(26)17-7-3-4-8-18(17)24-22(25)29-14-15-6-5-11-23-13-15/h3-13H,14H2,1-2H3