N-(4-bromanyl-2-methyl-phenyl)-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[4-(2-fluorophenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[4-(2-fluorophenyl)sulfonylpiperazino]acetamide Formula: C19H21BrFN3O3S MolecularWeight: 470.355743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C19H21BrFN3O3S/c1-14-12-15(20)6-7-17(14)22-19(25)13-23-8-10-24(11-9-23)28(26,27)18-5-3-2-4-16(18)21/h2-7,12H,8-11,13H2,1H3,(H,22,25)