1-cyclopropyl-1-(pyridin-4-ylmethyl)-3-[4-(trifluoromethyloxy)phenyl]thiourea

Systemtic Name: 1-cyclopropyl-1-(pyridin-4-ylmethyl)-3-[4-(trifluoromethyloxy)phenyl]thiourea Openeye Name: 1-cyclopropyl-1-(4-pyridylmethyl)-3-[4-(trifluoromethoxy)phenyl]thiourea CAS Name: 1-cyclopropyl-1-(pyridin-4-ylmethyl)-3-[4-(trifluoromethoxy)phenyl]thiourea IUPAC Name: 1-cyclopropyl-1-(pyridin-4-ylmethyl)-3-[4-(trifluoromethoxy)phenyl]thiourea Traditional Name: 1-cyclopropyl-1-(4-pyridylmethyl)-3-[4-(trifluoromethoxy)phenyl]thiourea Formula: C17H16F3N3OS MolecularWeight: 367.38865

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC2=CC=NC=C2)C(=S)NC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

C1CC1N(CC2=CC=NC=C2)C(=S)NC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C17H16F3N3OS/c18-17(19,20)24-15-5-1-13(2-6-15)22-16(25)23(14-3-4-14)11-12-7-9-21-10-8-12/h1-2,5-10,14H,3-4,11H2,(H,22,25)