3-[3-chloranyl-4-(trifluoromethyl)phenyl]-1-cyclopentyl-1-(furan-2-ylmethyl)thiourea

Systemtic Name: 3-[3-chloranyl-4-(trifluoromethyl)phenyl]-1-cyclopentyl-1-(furan-2-ylmethyl)thiourea Openeye Name: 3-[3-chloro-4-(trifluoromethyl)phenyl]-1-cyclopentyl-1-(2-furylmethyl)thiourea CAS Name: 3-[3-chloro-4-(trifluoromethyl)phenyl]-1-cyclopentyl-1-(2-furanylmethyl)thiourea IUPAC Name: 3-[3-chloro-4-(trifluoromethyl)phenyl]-1-cyclopentyl-1-(furan-2-ylmethyl)thiourea Traditional Name: 3-[3-chloro-4-(trifluoromethyl)phenyl]-1-cyclopentyl-1-(2-furfuryl)thiourea Formula: C18H18ClF3N2OS MolecularWeight: 402.86153

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N(CC2=CC=CO2)C(=S)NC3=CC(=C(C=C3)C(F)(F)F)Cl

Isomeric SMILES

C1CCC(C1)N(CC2=CC=CO2)C(=S)NC3=CC(=C(C=C3)C(F)(F)F)Cl

InChI

InChI=1S/C18H18ClF3N2OS/c19-16-10-12(7-8-15(16)18(20,21)22)23-17(26)24(13-4-1-2-5-13)11-14-6-3-9-25-14/h3,6-10,13H,1-2,4-5,11H2,(H,23,26)