1-[2-nitro-4-(trifluoromethyloxy)phenyl]thiourea

Systemtic Name: 1-[2-nitro-4-(trifluoromethyloxy)phenyl]thiourea Openeye Name: [2-nitro-4-(trifluoromethoxy)phenyl]thiourea CAS Name: [2-nitro-4-(trifluoromethoxy)phenyl]thiourea IUPAC Name: [2-nitro-4-(trifluoromethoxy)phenyl]thiourea Traditional Name: [2-nitro-4-(trifluoromethoxy)phenyl]thiourea Formula: C8H6F3N3O3S MolecularWeight: 281.21175

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1OC(F)(F)F)[N+](=O)[O-])NC(=S)N

Isomeric SMILES

C1=CC(=C(C=C1OC(F)(F)F)[N+](=O)[O-])NC(=S)N

InChI

InChI=1S/C8H6F3N3O3S/c9-8(10,11)17-4-1-2-5(13-7(12)18)6(3-4)14(15)16/h1-3H,(H3,12,13,18)