3-methyl-N-[5-piperidin-1-ylsulfonyl-2-[2,2,2-tris(fluoranyl)ethoxy]phenyl]but-2-enamide

Systemtic Name: 3-methyl-N-[5-piperidin-1-ylsulfonyl-2-[2,2,2-tris(fluoranyl)ethoxy]phenyl]but-2-enamide Openeye Name: 3-methyl-N-[5-(1-piperidylsulfonyl)-2-(2,2,2-trifluoroethoxy)phenyl]but-2-enamide CAS Name: 3-methyl-N-[5-(1-piperidinylsulfonyl)-2-(2,2,2-trifluoroethoxy)phenyl]-2-butenamide IUPAC Name: 3-methyl-N-[5-piperidin-1-ylsulfonyl-2-(2,2,2-trifluoroethoxy)phenyl]but-2-enamide Traditional Name: 3-methyl-N-[5-piperidinosulfonyl-2-(2,2,2-trifluoroethoxy)phenyl]but-2-enamide Formula: C18H23F3N2O4S MolecularWeight: 420.44643

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2)OCC(F)(F)F)C

Isomeric SMILES

CC(=CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2)OCC(F)(F)F)C

InChI

InChI=1S/C18H23F3N2O4S/c1-13(2)10-17(24)22-15-11-14(6-7-16(15)27-12-18(19,20)21)28(25,26)23-8-4-3-5-9-23/h6-7,10-11H,3-5,8-9,12H2,1-2H3,(H,22,24)