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

Systemtic Name: 2-[2-(3-bromanylphenoxy)ethylsulfanyl]-3-(3,5-dimethylphenyl)quinazolin-4-one Openeye Name: 2-[2-(3-bromophenoxy)ethylsulfanyl]-3-(3,5-dimethylphenyl)quinazolin-4-one CAS Name: 2-[2-(3-bromophenoxy)ethylthio]-3-(3,5-dimethylphenyl)-4-quinazolinone IUPAC Name: 2-[2-(3-bromophenoxy)ethylsulfanyl]-3-(3,5-dimethylphenyl)quinazolin-4-one Traditional Name: 2-[2-(3-bromophenoxy)ethylthio]-3-(3,5-dimethylphenyl)quinazolin-4-one Formula: C24H21BrN2O2S MolecularWeight: 481.40474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCCOC4=CC(=CC=C4)Br)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCCOC4=CC(=CC=C4)Br)C

InChI

InChI=1S/C24H21BrN2O2S/c1-16-12-17(2)14-19(13-16)27-23(28)21-8-3-4-9-22(21)26-24(27)30-11-10-29-20-7-5-6-18(25)15-20/h3-9,12-15H,10-11H2,1-2H3