1-(4-nitrophenyl)-3-[2,2,2-tris(fluoranyl)ethyl]thiourea

Systemtic Name: 1-(4-nitrophenyl)-3-[2,2,2-tris(fluoranyl)ethyl]thiourea Openeye Name: 1-(4-nitrophenyl)-3-(2,2,2-trifluoroethyl)thiourea CAS Name: 1-(4-nitrophenyl)-3-(2,2,2-trifluoroethyl)thiourea IUPAC Name: 1-(4-nitrophenyl)-3-(2,2,2-trifluoroethyl)thiourea Traditional Name: 1-(4-nitrophenyl)-3-(2,2,2-trifluoroethyl)thiourea Formula: C9H8F3N3O2S MolecularWeight: 279.23893

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NCC(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NCC(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C9H8F3N3O2S/c10-9(11,12)5-13-8(18)14-6-1-3-7(4-2-6)15(16)17/h1-4H,5H2,(H2,13,14,18)