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1-cyclohexyl-3-[[2,6-dinitro-4-(trifluoromethyl)phenyl]amino]thiourea

1-cyclohexyl-3-[[2,6-dinitro-4-(trifluoromethyl)phenyl]amino]thiourea

Systemtic Name:1-cyclohexyl-3-[[2,6-dinitro-4-(trifluoromethyl)phenyl]amino]thiourea
Openeye Name:1-cyclohexyl-3-[2,6-dinitro-4-(trifluoromethyl)anilino]thiourea
CAS Name:1-cyclohexyl-3-[2,6-dinitro-4-(trifluoromethyl)anilino]thiourea
IUPAC Name:1-cyclohexyl-3-[2,6-dinitro-4-(trifluoromethyl)anilino]thiourea
Traditional Name:1-cyclohexyl-3-[2,6-dinitro-4-(trifluoromethyl)anilino]thiourea
Formula: C14H16F3N5O4S
MolecularWeight: 407.36815
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NNC2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]


Isomeric SMILES

C1CCC(CC1)NC(=S)NNC2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]


InChI

InChI=1S/C14H16F3N5O4S/c15-14(16,17)8-6-10(21(23)24)12(11(7-8)22(25)26)19-20-13(27)18-9-4-2-1-3-5-9/h6-7,9,19H,1-5H2,(H2,18,20,27)


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