1-cyclohexyl-3-[3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-3-oxidanylidene-propyl]urea

Systemtic Name: 1-cyclohexyl-3-[3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-3-oxidanylidene-propyl]urea Openeye Name: 1-cyclohexyl-3-[3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-3-oxo-propyl]urea CAS Name: 1-cyclohexyl-3-[3-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]-3-oxopropyl]urea IUPAC Name: 1-cyclohexyl-3-[3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-3-oxopropyl]urea Traditional Name: 1-cyclohexyl-3-[3-keto-3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]propyl]urea Formula: C21H28F3N5O4 MolecularWeight: 471.47333

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NCCC(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)NC(=O)NCCC(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C21H28F3N5O4/c22-21(23,24)15-6-7-17(18(14-15)29(32)33)27-10-12-28(13-11-27)19(30)8-9-25-20(31)26-16-4-2-1-3-5-16/h6-7,14,16H,1-5,8-13H2,(H2,25,26,31)