N-[2-(ethylamino)-5-(trifluoromethylsulfonyl)phenyl]-4-methyl-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-(ethylamino)-5-(trifluoromethylsulfonyl)phenyl]-4-methyl-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(ethylamino)-5-(trifluoromethylsulfonyl)phenyl]-4-methyl-3-(1-piperidylsulfonyl)benzamide CAS Name: N-[2-(ethylamino)-5-(trifluoromethylsulfonyl)phenyl]-4-methyl-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[2-(ethylamino)-5-(trifluoromethylsulfonyl)phenyl]-4-methyl-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(ethylamino)-5-triflyl-phenyl]-4-methyl-3-piperidinosulfonyl-benzamide Formula: C22H26F3N3O5S2 MolecularWeight: 533.58415

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C(C=C1)S(=O)(=O)C(F)(F)F)NC(=O)C2=CC(=C(C=C2)C)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCNC1=C(C=C(C=C1)S(=O)(=O)C(F)(F)F)NC(=O)C2=CC(=C(C=C2)C)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H26F3N3O5S2/c1-3-26-18-10-9-17(34(30,31)22(23,24)25)14-19(18)27-21(29)16-8-7-15(2)20(13-16)35(32,33)28-11-5-4-6-12-28/h7-10,13-14,26H,3-6,11-12H2,1-2H3,(H,27,29)