1-(3-pyrazol-1-ylpropyl)-3-[3-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-(3-pyrazol-1-ylpropyl)-3-[3-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-(3-pyrazol-1-ylpropyl)-3-[3-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[3-(1-pyrazolyl)propyl]-3-[3-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(3-pyrazol-1-ylpropyl)-3-[3-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-(3-pyrazol-1-ylpropyl)-3-[3-(trifluoromethyl)phenyl]thiourea Formula: C14H15F3N4S MolecularWeight: 328.35591

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=S)NCCCN2C=CC=N2)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC(=S)NCCCN2C=CC=N2)C(F)(F)F

InChI

InChI=1S/C14H15F3N4S/c15-14(16,17)11-4-1-5-12(10-11)20-13(22)18-6-2-8-21-9-3-7-19-21/h1,3-5,7,9-10H,2,6,8H2,(H2,18,20,22)