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

Systemtic Name: 1-[3,5-bis(trifluoromethyl)phenyl]thiourea Openeye Name: [3,5-bis(trifluoromethyl)phenyl]thiourea CAS Name: [3,5-bis(trifluoromethyl)phenyl]thiourea IUPAC Name: [3,5-bis(trifluoromethyl)phenyl]thiourea Traditional Name: [3,5-bis(trifluoromethyl)phenyl]thiourea Formula: C9H6F6N2S MolecularWeight: 288.212759

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(F)(F)F)NC(=S)N)C(F)(F)F

Isomeric SMILES

C1=C(C=C(C=C1C(F)(F)F)NC(=S)N)C(F)(F)F

InChI

InChI=1S/C9H6F6N2S/c10-8(11,12)4-1-5(9(13,14)15)3-6(2-4)17-7(16)18/h1-3H,(H3,16,17,18)