2-[(4-bromophenyl)methylsulfanyl]-3-(2,4-dimethylphenyl)quinazolin-4-one

Systemtic Name: 2-[(4-bromophenyl)methylsulfanyl]-3-(2,4-dimethylphenyl)quinazolin-4-one Openeye Name: 2-[(4-bromophenyl)methylsulfanyl]-3-(2,4-dimethylphenyl)quinazolin-4-one CAS Name: 2-[(4-bromophenyl)methylthio]-3-(2,4-dimethylphenyl)-4-quinazolinone IUPAC Name: 2-[(4-bromophenyl)methylsulfanyl]-3-(2,4-dimethylphenyl)quinazolin-4-one Traditional Name: 2-[(4-bromobenzyl)thio]-3-(2,4-dimethylphenyl)quinazolin-4-one Formula: C23H19BrN2OS MolecularWeight: 451.37876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=C(C=C4)Br)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=C(C=C4)Br)C

InChI

InChI=1S/C23H19BrN2OS/c1-15-7-12-21(16(2)13-15)26-22(27)19-5-3-4-6-20(19)25-23(26)28-14-17-8-10-18(24)11-9-17/h3-13H,14H2,1-2H3