2-(3-bromophenyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]quinazoline

Systemtic Name: 2-(3-bromophenyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]quinazoline Openeye Name: 2-(3-bromophenyl)-4-[4-(p-tolylsulfonyl)piperazin-1-yl]quinazoline CAS Name: 2-(3-bromophenyl)-4-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]quinazoline IUPAC Name: 2-(3-bromophenyl)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]quinazoline Traditional Name: 2-(3-bromophenyl)-4-(4-tosylpiperazino)quinazoline Formula: C25H23BrN4O2S MolecularWeight: 523.44472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC(=NC4=CC=CC=C43)C5=CC(=CC=C5)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC(=NC4=CC=CC=C43)C5=CC(=CC=C5)Br

InChI

InChI=1S/C25H23BrN4O2S/c1-18-9-11-21(12-10-18)33(31,32)30-15-13-29(14-16-30)25-22-7-2-3-8-23(22)27-24(28-25)19-5-4-6-20(26)17-19/h2-12,17H,13-16H2,1H3