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

Systemtic Name: 3-[(3,4-dimethoxyphenyl)methyl]-2-(2-oxidanylidenepropylsulfanyl)quinazolin-4-one Openeye Name: 2-acetonylsulfanyl-3-[(3,4-dimethoxyphenyl)methyl]quinazolin-4-one CAS Name: 3-[(3,4-dimethoxyphenyl)methyl]-2-(2-oxopropylthio)-4-quinazolinone IUPAC Name: 3-[(3,4-dimethoxyphenyl)methyl]-2-(2-oxopropylsulfanyl)quinazolin-4-one Traditional Name: 2-(acetonylthio)-3-veratryl-quinazolin-4-one Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H20N2O4S/c1-13(23)12-27-20-21-16-7-5-4-6-15(16)19(24)22(20)11-14-8-9-17(25-2)18(10-14)26-3/h4-10H,11-12H2,1-3H3