3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[2-(trifluoromethyl)cyclohexyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[2-(trifluoromethyl)cyclohexyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[2-(trifluoromethyl)cyclohexyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-[2-(trifluoromethyl)cyclohexyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[2-(trifluoromethyl)cyclohexyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[2-(trifluoromethyl)cyclohexyl]benzamide Formula: C20H26ClF3N2O3S MolecularWeight: 466.94525

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3CCCCC3C(F)(F)F)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3CCCCC3C(F)(F)F)Cl

InChI

InChI=1S/C20H26ClF3N2O3S/c21-16-10-9-14(13-18(16)30(28,29)26-11-5-1-2-6-12-26)19(27)25-17-8-4-3-7-15(17)20(22,23)24/h9-10,13,15,17H,1-8,11-12H2,(H,25,27)