4-bromanyl-N-[2-[4-(4-fluoranyl-2-methylsulfonyl-phenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N-phenyl-benzamide

Systemtic Name: 4-bromanyl-N-[2-[4-(4-fluoranyl-2-methylsulfonyl-phenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N-phenyl-benzamide Openeye Name: 4-bromo-N-[2-[4-(4-fluoro-2-methylsulfonyl-phenyl)piperazin-1-yl]-2-oxo-ethyl]-N-phenyl-benzamide CAS Name: 4-bromo-N-[2-[4-(4-fluoro-2-methylsulfonylphenyl)-1-piperazinyl]-2-oxoethyl]-N-phenylbenzamide IUPAC Name: 4-bromo-N-[2-[4-(4-fluoro-2-methylsulfonylphenyl)piperazin-1-yl]-2-oxoethyl]-N-phenylbenzamide Traditional Name: 4-bromo-N-[2-[4-(4-fluoro-2-mesyl-phenyl)piperazino]-2-keto-ethyl]-N-phenyl-benzamide Formula: C26H25BrFN3O4S MolecularWeight: 574.461803

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)F)N2CCN(CC2)C(=O)CN(C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)F)N2CCN(CC2)C(=O)CN(C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C26H25BrFN3O4S/c1-36(34,35)24-17-21(28)11-12-23(24)29-13-15-30(16-14-29)25(32)18-31(22-5-3-2-4-6-22)26(33)19-7-9-20(27)10-8-19/h2-12,17H,13-16,18H2,1H3