N-(2,3-dimethylphenyl)-5-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-2-fluoranyl-benzamide

Systemtic Name: N-(2,3-dimethylphenyl)-5-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-2-fluoranyl-benzamide Openeye Name: N-(2,3-dimethylphenyl)-5-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-2-fluoro-benzamide CAS Name: N-(2,3-dimethylphenyl)-5-[[4-(2,3-dimethylphenyl)-1-piperazinyl]sulfonyl]-2-fluorobenzamide IUPAC Name: N-(2,3-dimethylphenyl)-5-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-2-fluorobenzamide Traditional Name: N-(2,3-dimethylphenyl)-5-[4-(2,3-dimethylphenyl)piperazino]sulfonyl-2-fluoro-benzamide Formula: C27H30FN3O3S MolecularWeight: 495.608803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC(=C4C)C)F)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC(=C4C)C)F)C

InChI

InChI=1S/C27H30FN3O3S/c1-18-7-5-9-25(20(18)3)29-27(32)23-17-22(11-12-24(23)28)35(33,34)31-15-13-30(14-16-31)26-10-6-8-19(2)21(26)4/h5-12,17H,13-16H2,1-4H3,(H,29,32)