3-(3,5-dimethylphenyl)-2-[2-(4-methylphenoxy)ethylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(3,5-dimethylphenyl)-2-[2-(4-methylphenoxy)ethylsulfanyl]quinazolin-4-one Openeye Name: 3-(3,5-dimethylphenyl)-2-[2-(4-methylphenoxy)ethylsulfanyl]quinazolin-4-one CAS Name: 3-(3,5-dimethylphenyl)-2-[2-(4-methylphenoxy)ethylthio]-4-quinazolinone IUPAC Name: 3-(3,5-dimethylphenyl)-2-[2-(4-methylphenoxy)ethylsulfanyl]quinazolin-4-one Traditional Name: 3-(3,5-dimethylphenyl)-2-[2-(4-methylphenoxy)ethylthio]quinazolin-4-one Formula: C25H24N2O2S MolecularWeight: 416.53526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCSC2=NC3=CC=CC=C3C(=O)N2C4=CC(=CC(=C4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)OCCSC2=NC3=CC=CC=C3C(=O)N2C4=CC(=CC(=C4)C)C

InChI

InChI=1S/C25H24N2O2S/c1-17-8-10-21(11-9-17)29-12-13-30-25-26-23-7-5-4-6-22(23)24(28)27(25)20-15-18(2)14-19(3)16-20/h4-11,14-16H,12-13H2,1-3H3