1-(1-ethyl-3-methyl-pyrazol-4-yl)-3-[2-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-(1-ethyl-3-methyl-pyrazol-4-yl)-3-[2-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-(1-ethyl-3-methyl-pyrazol-4-yl)-3-[2-(trifluoromethyl)phenyl]thiourea CAS Name: 1-(1-ethyl-3-methyl-4-pyrazolyl)-3-[2-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(1-ethyl-3-methylpyrazol-4-yl)-3-[2-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-(1-ethyl-3-methyl-pyrazol-4-yl)-3-[2-(trifluoromethyl)phenyl]thiourea Formula: C14H15F3N4S MolecularWeight: 328.35591

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)NC(=S)NC2=CC=CC=C2C(F)(F)F

Isomeric SMILES

CCN1C=C(C(=N1)C)NC(=S)NC2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C14H15F3N4S/c1-3-21-8-12(9(2)20-21)19-13(22)18-11-7-5-4-6-10(11)14(15,16)17/h4-8H,3H2,1-2H3,(H2,18,19,22)