2-[(4-bromophenyl)methylsulfanyl]-3-(4-methylphenyl)carbonyl-quinazolin-4-one

Systemtic Name: 2-[(4-bromophenyl)methylsulfanyl]-3-(4-methylphenyl)carbonyl-quinazolin-4-one Openeye Name: 2-[(4-bromophenyl)methylsulfanyl]-3-(4-methylbenzoyl)quinazolin-4-one CAS Name: 2-[(4-bromophenyl)methylthio]-3-[(4-methylphenyl)-oxomethyl]-4-quinazolinone IUPAC Name: 2-[(4-bromophenyl)methylsulfanyl]-3-(4-methylbenzoyl)quinazolin-4-one Traditional Name: 2-[(4-bromobenzyl)thio]-3-p-toluoyl-quinazolin-4-one Formula: C23H17BrN2O2S MolecularWeight: 465.36228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H17BrN2O2S/c1-15-6-10-17(11-7-15)21(27)26-22(28)19-4-2-3-5-20(19)25-23(26)29-14-16-8-12-18(24)13-9-16/h2-13H,14H2,1H3