N-(2-chlorophenyl)-2-fluoranyl-5-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]sulfonyl-benzamide

Systemtic Name: N-(2-chlorophenyl)-2-fluoranyl-5-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]sulfonyl-benzamide Openeye Name: N-(2-chlorophenyl)-2-fluoro-5-[3-methyl-4-(m-tolyl)piperazin-1-yl]sulfonyl-benzamide CAS Name: N-(2-chlorophenyl)-2-fluoro-5-[[3-methyl-4-(3-methylphenyl)-1-piperazinyl]sulfonyl]benzamide IUPAC Name: N-(2-chlorophenyl)-2-fluoro-5-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]sulfonylbenzamide Traditional Name: N-(2-chlorophenyl)-2-fluoro-5-[3-methyl-4-(m-tolyl)piperazino]sulfonyl-benzamide Formula: C25H25ClFN3O3S MolecularWeight: 502.000703

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=CC(=C2)C)S(=O)(=O)C3=CC(=C(C=C3)F)C(=O)NC4=CC=CC=C4Cl

Isomeric SMILES

CC1CN(CCN1C2=CC=CC(=C2)C)S(=O)(=O)C3=CC(=C(C=C3)F)C(=O)NC4=CC=CC=C4Cl

InChI

InChI=1S/C25H25ClFN3O3S/c1-17-6-5-7-19(14-17)30-13-12-29(16-18(30)2)34(32,33)20-10-11-23(27)21(15-20)25(31)28-24-9-4-3-8-22(24)26/h3-11,14-15,18H,12-13,16H2,1-2H3,(H,28,31)