3-[(3,4-dimethoxyphenyl)methyl]-2-(phenylmethylsulfanyl)quinazolin-4-one

Systemtic Name: 3-[(3,4-dimethoxyphenyl)methyl]-2-(phenylmethylsulfanyl)quinazolin-4-one Openeye Name: 2-benzylsulfanyl-3-[(3,4-dimethoxyphenyl)methyl]quinazolin-4-one CAS Name: 3-[(3,4-dimethoxyphenyl)methyl]-2-(phenylmethylthio)-4-quinazolinone IUPAC Name: 2-benzylsulfanyl-3-[(3,4-dimethoxyphenyl)methyl]quinazolin-4-one Traditional Name: 2-(benzylthio)-3-veratryl-quinazolin-4-one Formula: C24H22N2O3S MolecularWeight: 418.50808

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC=C4)OC

InChI

InChI=1S/C24H22N2O3S/c1-28-21-13-12-18(14-22(21)29-2)15-26-23(27)19-10-6-7-11-20(19)25-24(26)30-16-17-8-4-3-5-9-17/h3-14H,15-16H2,1-2H3