3-(4-methoxyphenyl)-2-(3-methylbutylsulfanyl)quinazolin-4-one

Systemtic Name: 3-(4-methoxyphenyl)-2-(3-methylbutylsulfanyl)quinazolin-4-one Openeye Name: 2-isopentylsulfanyl-3-(4-methoxyphenyl)quinazolin-4-one CAS Name: 3-(4-methoxyphenyl)-2-(3-methylbutylthio)-4-quinazolinone IUPAC Name: 3-(4-methoxyphenyl)-2-(3-methylbutylsulfanyl)quinazolin-4-one Traditional Name: 2-(isoamylthio)-3-(4-methoxyphenyl)quinazolin-4-one Formula: C20H22N2O2S MolecularWeight: 354.46588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)CCSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H22N2O2S/c1-14(2)12-13-25-20-21-18-7-5-4-6-17(18)19(23)22(20)15-8-10-16(24-3)11-9-15/h4-11,14H,12-13H2,1-3H3