N-(2-bromophenyl)-2-fluoranyl-5-(4-phenylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(2-bromophenyl)-2-fluoranyl-5-(4-phenylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-(2-bromophenyl)-2-fluoro-5-(4-phenylpiperazin-1-yl)sulfonyl-benzamide CAS Name: N-(2-bromophenyl)-2-fluoro-5-[(4-phenyl-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-(2-bromophenyl)-2-fluoro-5-(4-phenylpiperazin-1-yl)sulfonylbenzamide Traditional Name: N-(2-bromophenyl)-2-fluoro-5-(4-phenylpiperazino)sulfonyl-benzamide Formula: C23H21BrFN3O3S MolecularWeight: 518.398543

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)C3=CC(=C(C=C3)F)C(=O)NC4=CC=CC=C4Br

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)C3=CC(=C(C=C3)F)C(=O)NC4=CC=CC=C4Br

InChI

InChI=1S/C23H21BrFN3O3S/c24-20-8-4-5-9-22(20)26-23(29)19-16-18(10-11-21(19)25)32(30,31)28-14-12-27(13-15-28)17-6-2-1-3-7-17/h1-11,16H,12-15H2,(H,26,29)