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

Systemtic Name: 1-cyclopentyl-1-(pyridin-4-ylmethyl)-3-[2-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-cyclopentyl-1-(4-pyridylmethyl)-3-[2-(trifluoromethyl)phenyl]thiourea CAS Name: 1-cyclopentyl-1-(pyridin-4-ylmethyl)-3-[2-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-cyclopentyl-1-(pyridin-4-ylmethyl)-3-[2-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-cyclopentyl-1-(4-pyridylmethyl)-3-[2-(trifluoromethyl)phenyl]thiourea Formula: C19H20F3N3S MolecularWeight: 379.44241

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N(CC2=CC=NC=C2)C(=S)NC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C1CCC(C1)N(CC2=CC=NC=C2)C(=S)NC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C19H20F3N3S/c20-19(21,22)16-7-3-4-8-17(16)24-18(26)25(15-5-1-2-6-15)13-14-9-11-23-12-10-14/h3-4,7-12,15H,1-2,5-6,13H2,(H,24,26)