2-cyclopentylsulfanyl-N-[2-[[2-nitro-4-(trifluoromethyl)phenyl]amino]ethyl]ethanamide

Systemtic Name: 2-cyclopentylsulfanyl-N-[2-[[2-nitro-4-(trifluoromethyl)phenyl]amino]ethyl]ethanamide Openeye Name: 2-cyclopentylsulfanyl-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]acetamide CAS Name: 2-(cyclopentylthio)-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]acetamide IUPAC Name: 2-cyclopentylsulfanyl-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]acetamide Traditional Name: 2-(cyclopentylthio)-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]acetamide Formula: C16H20F3N3O3S MolecularWeight: 391.40851

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)SCC(=O)NCCNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)SCC(=O)NCCNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H20F3N3O3S/c17-16(18,19)11-5-6-13(14(9-11)22(24)25)20-7-8-21-15(23)10-26-12-3-1-2-4-12/h5-6,9,12,20H,1-4,7-8,10H2,(H,21,23)