N-(1-cyclohexylcarbonylpiperidin-4-yl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(1-cyclohexylcarbonylpiperidin-4-yl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-ethanamide Openeye Name: N-[1-(cyclohexanecarbonyl)-4-piperidyl]-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-acetamide CAS Name: N-[1-[cyclohexyl(oxo)methyl]-4-piperidinyl]-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]acetamide IUPAC Name: N-[1-(cyclohexanecarbonyl)piperidin-4-yl]-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylacetamide Traditional Name: N-[1-(cyclohexanecarbonyl)-4-piperidyl]-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]acetamide Formula: C21H26F3N3O4S MolecularWeight: 473.50905

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N2CCC(CC2)NC(=O)CSC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)C(=O)N2CCC(CC2)NC(=O)CSC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C21H26F3N3O4S/c22-21(23,24)15-6-7-18(17(12-15)27(30)31)32-13-19(28)25-16-8-10-26(11-9-16)20(29)14-4-2-1-3-5-14/h6-7,12,14,16H,1-5,8-11,13H2,(H,25,28)