1-[3,5-bis(trifluoromethyl)phenyl]-3-(4-ethanoylphenyl)thiourea

Systemtic Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(4-ethanoylphenyl)thiourea Openeye Name: 1-(4-acetylphenyl)-3-[3,5-bis(trifluoromethyl)phenyl]thiourea CAS Name: 1-(4-acetylphenyl)-3-[3,5-bis(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(4-acetylphenyl)-3-[3,5-bis(trifluoromethyl)phenyl]thiourea Traditional Name: 1-(4-acetylphenyl)-3-[3,5-bis(trifluoromethyl)phenyl]thiourea Formula: C17H12F6N2OS MolecularWeight: 406.345399

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C17H12F6N2OS/c1-9(26)10-2-4-13(5-3-10)24-15(27)25-14-7-11(16(18,19)20)6-12(8-14)17(21,22)23/h2-8H,1H3,(H2,24,25,27)