1-(4-methyl-3-nitro-phenyl)-3-[3-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-(4-methyl-3-nitro-phenyl)-3-[3-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-(4-methyl-3-nitro-phenyl)-3-[3-(trifluoromethyl)phenyl]thiourea CAS Name: 1-(4-methyl-3-nitrophenyl)-3-[3-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(4-methyl-3-nitrophenyl)-3-[3-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-(4-methyl-3-nitro-phenyl)-3-[3-(trifluoromethyl)phenyl]thiourea Formula: C15H12F3N3O2S MolecularWeight: 355.33489

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NC2=CC=CC(=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC2=CC=CC(=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C15H12F3N3O2S/c1-9-5-6-12(8-13(9)21(22)23)20-14(24)19-11-4-2-3-10(7-11)15(16,17)18/h2-8H,1H3,(H2,19,20,24)