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

Systemtic Name: 3-[(3,4-dimethoxyphenyl)methyl]-2-phenacylsulfanyl-quinazolin-4-one Openeye Name: 3-[(3,4-dimethoxyphenyl)methyl]-2-phenacylsulfanyl-quinazolin-4-one CAS Name: 3-[(3,4-dimethoxyphenyl)methyl]-2-(phenacylthio)-4-quinazolinone IUPAC Name: 3-[(3,4-dimethoxyphenyl)methyl]-2-phenacylsulfanylquinazolin-4-one Traditional Name: 2-(phenacylthio)-3-veratryl-quinazolin-4-one Formula: C25H22N2O4S MolecularWeight: 446.51818

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=CC=C4)OC

InChI

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