6-bromanyl-4-[4-(2-fluoranyl-5-methylsulfonyl-phenyl)piperazin-1-yl]quinazoline

Systemtic Name: 6-bromanyl-4-[4-(2-fluoranyl-5-methylsulfonyl-phenyl)piperazin-1-yl]quinazoline Openeye Name: 6-bromo-4-[4-(2-fluoro-5-methylsulfonyl-phenyl)piperazin-1-yl]quinazoline CAS Name: 6-bromo-4-[4-(2-fluoro-5-methylsulfonylphenyl)-1-piperazinyl]quinazoline IUPAC Name: 6-bromo-4-[4-(2-fluoro-5-methylsulfonylphenyl)piperazin-1-yl]quinazoline Traditional Name: 6-bromo-4-[4-(2-fluoro-5-mesyl-phenyl)piperazino]quinazoline Formula: C19H18BrFN4O2S MolecularWeight: 465.339223

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)F)N2CCN(CC2)C3=NC=NC4=C3C=C(C=C4)Br

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)F)N2CCN(CC2)C3=NC=NC4=C3C=C(C=C4)Br

InChI

InChI=1S/C19H18BrFN4O2S/c1-28(26,27)14-3-4-16(21)18(11-14)24-6-8-25(9-7-24)19-15-10-13(20)2-5-17(15)22-12-23-19/h2-5,10-12H,6-9H2,1H3