2-[(4-bromophenyl)methylsulfanyl]-3-(4-butan-2-ylphenyl)quinazolin-4-one

Systemtic Name: 2-[(4-bromophenyl)methylsulfanyl]-3-(4-butan-2-ylphenyl)quinazolin-4-one Openeye Name: 2-[(4-bromophenyl)methylsulfanyl]-3-(4-sec-butylphenyl)quinazolin-4-one CAS Name: 2-[(4-bromophenyl)methylthio]-3-(4-butan-2-ylphenyl)-4-quinazolinone IUPAC Name: 2-[(4-bromophenyl)methylsulfanyl]-3-(4-butan-2-ylphenyl)quinazolin-4-one Traditional Name: 2-[(4-bromobenzyl)thio]-3-(4-sec-butylphenyl)quinazolin-4-one Formula: C25H23BrN2OS MolecularWeight: 479.43192

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H23BrN2OS/c1-3-17(2)19-10-14-21(15-11-19)28-24(29)22-6-4-5-7-23(22)27-25(28)30-16-18-8-12-20(26)13-9-18/h4-15,17H,3,16H2,1-2H3