N-(2-methyl-6-piperazin-1-yl-pyridin-3-yl)-4-[1,1,1-tris(fluoranyl)propan-2-yl]benzenesulfonamide

Systemtic Name: N-(2-methyl-6-piperazin-1-yl-pyridin-3-yl)-4-[1,1,1-tris(fluoranyl)propan-2-yl]benzenesulfonamide Openeye Name: N-(2-methyl-6-piperazin-1-yl-3-pyridyl)-4-(2,2,2-trifluoro-1-methyl-ethyl)benzenesulfonamide CAS Name: N-[2-methyl-6-(1-piperazinyl)-3-pyridinyl]-4-(1,1,1-trifluoropropan-2-yl)benzenesulfonamide IUPAC Name: N-(2-methyl-6-piperazin-1-ylpyridin-3-yl)-4-(1,1,1-trifluoropropan-2-yl)benzenesulfonamide Traditional Name: N-(2-methyl-6-piperazino-3-pyridyl)-4-(2,2,2-trifluoro-1-methyl-ethyl)benzenesulfonamide Formula: C19H23F3N4O2S MolecularWeight: 428.47173

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)N2CCNCC2)NS(=O)(=O)C3=CC=C(C=C3)C(C)C(F)(F)F

Isomeric SMILES

CC1=C(C=CC(=N1)N2CCNCC2)NS(=O)(=O)C3=CC=C(C=C3)C(C)C(F)(F)F

InChI

InChI=1S/C19H23F3N4O2S/c1-13(19(20,21)22)15-3-5-16(6-4-15)29(27,28)25-17-7-8-18(24-14(17)2)26-11-9-23-10-12-26/h3-8,13,23,25H,9-12H2,1-2H3