1-(furan-2-ylmethyl)-1-(3-pyrrolidin-1-ylpropyl)-3-[3-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-(furan-2-ylmethyl)-1-(3-pyrrolidin-1-ylpropyl)-3-[3-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-(2-furylmethyl)-1-(3-pyrrolidin-1-ylpropyl)-3-[3-(trifluoromethyl)phenyl]thiourea CAS Name: 1-(2-furanylmethyl)-1-[3-(1-pyrrolidinyl)propyl]-3-[3-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(furan-2-ylmethyl)-1-(3-pyrrolidin-1-ylpropyl)-3-[3-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-(2-furfuryl)-1-(3-pyrrolidinopropyl)-3-[3-(trifluoromethyl)phenyl]thiourea Formula: C20H24F3N3OS MolecularWeight: 411.48427

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCN(CC2=CC=CO2)C(=S)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CCN(C1)CCCN(CC2=CC=CO2)C(=S)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C20H24F3N3OS/c21-20(22,23)16-6-3-7-17(14-16)24-19(28)26(15-18-8-4-13-27-18)12-5-11-25-9-1-2-10-25/h3-4,6-8,13-14H,1-2,5,9-12,15H2,(H,24,28)