N-(2,6-dimethylphenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-benzamide

Systemtic Name: N-(2,6-dimethylphenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-benzamide Openeye Name: N-(2,6-dimethylphenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-benzamide CAS Name: N-(2,6-dimethylphenyl)-3-[[4-(4-fluorophenyl)-1-piperazinyl]sulfonyl]benzamide IUPAC Name: N-(2,6-dimethylphenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylbenzamide Traditional Name: N-(2,6-dimethylphenyl)-3-[4-(4-fluorophenyl)piperazino]sulfonyl-benzamide Formula: C25H26FN3O3S MolecularWeight: 467.555643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H26FN3O3S/c1-18-5-3-6-19(2)24(18)27-25(30)20-7-4-8-23(17-20)33(31,32)29-15-13-28(14-16-29)22-11-9-21(26)10-12-22/h3-12,17H,13-16H2,1-2H3,(H,27,30)