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

Systemtic Name: 5-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-2-fluoranyl-N-(4-propan-2-ylphenyl)benzamide Openeye Name: 5-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-2-fluoro-N-(4-isopropylphenyl)benzamide CAS Name: 5-[[4-(2,3-dimethylphenyl)-1-piperazinyl]sulfonyl]-2-fluoro-N-(4-propan-2-ylphenyl)benzamide IUPAC Name: 5-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-2-fluoro-N-(4-propan-2-ylphenyl)benzamide Traditional Name: 5-[4-(2,3-dimethylphenyl)piperazino]sulfonyl-2-fluoro-N-p-cumenyl-benzamide Formula: C28H32FN3O3S MolecularWeight: 509.635383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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