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

Systemtic Name: 3-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-4-fluoranyl-N-(4-propan-2-ylphenyl)benzamide Openeye Name: 3-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-4-fluoro-N-(4-isopropylphenyl)benzamide CAS Name: 3-[[4-(2,3-dimethylphenyl)-1-piperazinyl]sulfonyl]-4-fluoro-N-(4-propan-2-ylphenyl)benzamide IUPAC Name: 3-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-4-fluoro-N-(4-propan-2-ylphenyl)benzamide Traditional Name: 3-[4-(2,3-dimethylphenyl)piperazino]sulfonyl-4-fluoro-N-p-cumenyl-benzamide Formula: C28H32FN3O3S MolecularWeight: 509.635383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C(=O)NC4=CC=C(C=C4)C(C)C)F)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C(=O)NC4=CC=C(C=C4)C(C)C)F)C

InChI

InChI=1S/C28H32FN3O3S/c1-19(2)22-8-11-24(12-9-22)30-28(33)23-10-13-25(29)27(18-23)36(34,35)32-16-14-31(15-17-32)26-7-5-6-20(3)21(26)4/h5-13,18-19H,14-17H2,1-4H3,(H,30,33)