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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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