N-[3-cyano-4-[2,2,2-tris(fluoranyl)ethoxy]phenyl]-2-methyl-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[3-cyano-4-[2,2,2-tris(fluoranyl)ethoxy]phenyl]-2-methyl-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[3-cyano-4-(2,2,2-trifluoroethoxy)phenyl]-2-methyl-5-(1-piperidylsulfonyl)benzamide CAS Name: N-[3-cyano-4-(2,2,2-trifluoroethoxy)phenyl]-2-methyl-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[3-cyano-4-(2,2,2-trifluoroethoxy)phenyl]-2-methyl-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[3-cyano-4-(2,2,2-trifluoroethoxy)phenyl]-2-methyl-5-piperidinosulfonyl-benzamide Formula: C22H22F3N3O4S MolecularWeight: 481.48799

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NC3=CC(=C(C=C3)OCC(F)(F)F)C#N

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NC3=CC(=C(C=C3)OCC(F)(F)F)C#N

InChI

InChI=1S/C22H22F3N3O4S/c1-15-5-7-18(33(30,31)28-9-3-2-4-10-28)12-19(15)21(29)27-17-6-8-20(16(11-17)13-26)32-14-22(23,24)25/h5-8,11-12H,2-4,9-10,14H2,1H3,(H,27,29)