3-[4-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]carbonylphenyl]quinazolin-4-one

Systemtic Name: 3-[4-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]carbonylphenyl]quinazolin-4-one Openeye Name: 3-[4-[4-(4-bromophenyl)sulfonylpiperazine-1-carbonyl]phenyl]quinazolin-4-one CAS Name: 3-[4-[[4-(4-bromophenyl)sulfonyl-1-piperazinyl]-oxomethyl]phenyl]-4-quinazolinone IUPAC Name: 3-[4-[4-(4-bromophenyl)sulfonylpiperazine-1-carbonyl]phenyl]quinazolin-4-one Traditional Name: 3-[4-(4-brosylpiperazine-1-carbonyl)phenyl]quinazolin-4-one Formula: C25H21BrN4O4S MolecularWeight: 553.42764

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(C=C2)N3C=NC4=CC=CC=C4C3=O)S(=O)(=O)C5=CC=C(C=C5)Br

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(C=C2)N3C=NC4=CC=CC=C4C3=O)S(=O)(=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C25H21BrN4O4S/c26-19-7-11-21(12-8-19)35(33,34)29-15-13-28(14-16-29)24(31)18-5-9-20(10-6-18)30-17-27-23-4-2-1-3-22(23)25(30)32/h1-12,17H,13-16H2