2-[2-oxidanylidene-1-[1-(propan-2-ylsulfonylmethyl)-4-pyrrolidin-1-yl-cyclohexyl]pyrrolidin-3-yl]-3-(trifluoromethyl)benzamide

Systemtic Name: 2-[2-oxidanylidene-1-[1-(propan-2-ylsulfonylmethyl)-4-pyrrolidin-1-yl-cyclohexyl]pyrrolidin-3-yl]-3-(trifluoromethyl)benzamide Openeye Name: 2-[1-[1-(isopropylsulfonylmethyl)-4-pyrrolidin-1-yl-cyclohexyl]-2-oxo-pyrrolidin-3-yl]-3-(trifluoromethyl)benzamide CAS Name: 2-[2-oxo-1-[1-(propan-2-ylsulfonylmethyl)-4-(1-pyrrolidinyl)cyclohexyl]-3-pyrrolidinyl]-3-(trifluoromethyl)benzamide IUPAC Name: 2-[2-oxo-1-[1-(propan-2-ylsulfonylmethyl)-4-pyrrolidin-1-ylcyclohexyl]pyrrolidin-3-yl]-3-(trifluoromethyl)benzamide Traditional Name: 2-[1-[1-(isopropylsulfonylmethyl)-4-pyrrolidino-cyclohexyl]-2-keto-pyrrolidin-3-yl]-3-(trifluoromethyl)benzamide Formula: C26H36F3N3O4S MolecularWeight: 543.64195

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)CC1(CCC(CC1)N2CCCC2)N3CCC(C3=O)C4=C(C=CC=C4C(F)(F)F)C(=O)N

Isomeric SMILES

CC(C)S(=O)(=O)CC1(CCC(CC1)N2CCCC2)N3CCC(C3=O)C4=C(C=CC=C4C(F)(F)F)C(=O)N

InChI

InChI=1S/C26H36F3N3O4S/c1-17(2)37(35,36)16-25(11-8-18(9-12-25)31-13-3-4-14-31)32-15-10-20(24(32)34)22-19(23(30)33)6-5-7-21(22)26(27,28)29/h5-7,17-18,20H,3-4,8-16H2,1-2H3,(H2,30,33)