N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-(trifluoromethyl)benzenesulfonamide CAS Name: N-[2-[[6-(1-azepanyl)-4-pyrimidinyl]oxy]ethyl]-2-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-(trifluoromethyl)benzenesulfonamide Formula: C19H23F3N4O3S MolecularWeight: 444.47113

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC(=NC=N2)OCCNS(=O)(=O)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C1CCCN(CC1)C2=CC(=NC=N2)OCCNS(=O)(=O)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C19H23F3N4O3S/c20-19(21,22)15-7-3-4-8-16(15)30(27,28)25-9-12-29-18-13-17(23-14-24-18)26-10-5-1-2-6-11-26/h3-4,7-8,13-14,25H,1-2,5-6,9-12H2