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

Systemtic Name: 1-cyclopentyl-1-(pyridin-3-ylmethyl)-3-[2-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-cyclopentyl-1-(3-pyridylmethyl)-3-[2-(trifluoromethyl)phenyl]thiourea CAS Name: 1-cyclopentyl-1-(3-pyridinylmethyl)-3-[2-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-cyclopentyl-1-(pyridin-3-ylmethyl)-3-[2-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-cyclopentyl-1-(3-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=CN=CC=C2)C(=S)NC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

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

InChI

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