3-(3,5-dimethylphenyl)-2-(2-methylpropylsulfanyl)quinazolin-4-one

Systemtic Name: 3-(3,5-dimethylphenyl)-2-(2-methylpropylsulfanyl)quinazolin-4-one Openeye Name: 3-(3,5-dimethylphenyl)-2-isobutylsulfanyl-quinazolin-4-one CAS Name: 3-(3,5-dimethylphenyl)-2-(2-methylpropylthio)-4-quinazolinone IUPAC Name: 3-(3,5-dimethylphenyl)-2-(2-methylpropylsulfanyl)quinazolin-4-one Traditional Name: 3-(3,5-dimethylphenyl)-2-(isobutylthio)quinazolin-4-one Formula: C20H22N2OS MolecularWeight: 338.46648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(C)C)C

InChI

InChI=1S/C20H22N2OS/c1-13(2)12-24-20-21-18-8-6-5-7-17(18)19(23)22(20)16-10-14(3)9-15(4)11-16/h5-11,13H,12H2,1-4H3