3-(4-bromophenyl)-2-[1-[4-(4-fluorophenyl)sulfonyl-3-methyl-piperazin-1-yl]propyl]quinazolin-4-one

Systemtic Name: 3-(4-bromophenyl)-2-[1-[4-(4-fluorophenyl)sulfonyl-3-methyl-piperazin-1-yl]propyl]quinazolin-4-one Openeye Name: 3-(4-bromophenyl)-2-[1-[4-(4-fluorophenyl)sulfonyl-3-methyl-piperazin-1-yl]propyl]quinazolin-4-one CAS Name: 3-(4-bromophenyl)-2-[1-[4-(4-fluorophenyl)sulfonyl-3-methyl-1-piperazinyl]propyl]-4-quinazolinone IUPAC Name: 3-(4-bromophenyl)-2-[1-[4-(4-fluorophenyl)sulfonyl-3-methylpiperazin-1-yl]propyl]quinazolin-4-one Traditional Name: 3-(4-bromophenyl)-2-[1-[4-(4-fluorophenyl)sulfonyl-3-methyl-piperazino]propyl]quinazolin-4-one Formula: C28H28BrFN4O3S MolecularWeight: 599.514323

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)Br)N4CCN(C(C4)C)S(=O)(=O)C5=CC=C(C=C5)F

Isomeric SMILES

CCC(C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)Br)N4CCN(C(C4)C)S(=O)(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C28H28BrFN4O3S/c1-3-26(32-16-17-33(19(2)18-32)38(36,37)23-14-10-21(30)11-15-23)27-31-25-7-5-4-6-24(25)28(35)34(27)22-12-8-20(29)9-13-22/h4-15,19,26H,3,16-18H2,1-2H3