1-(2-cyanoethyl)-1-(furan-2-ylmethyl)-3-[4-(trifluoromethyloxy)phenyl]thiourea

Systemtic Name: 1-(2-cyanoethyl)-1-(furan-2-ylmethyl)-3-[4-(trifluoromethyloxy)phenyl]thiourea Openeye Name: 1-(2-cyanoethyl)-1-(2-furylmethyl)-3-[4-(trifluoromethoxy)phenyl]thiourea CAS Name: 1-(2-cyanoethyl)-1-(2-furanylmethyl)-3-[4-(trifluoromethoxy)phenyl]thiourea IUPAC Name: 1-(2-cyanoethyl)-1-(furan-2-ylmethyl)-3-[4-(trifluoromethoxy)phenyl]thiourea Traditional Name: 1-(2-cyanoethyl)-1-(2-furfuryl)-3-[4-(trifluoromethoxy)phenyl]thiourea Formula: C16H14F3N3O2S MolecularWeight: 369.36147

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN(CCC#N)C(=S)NC2=CC=C(C=C2)OC(F)(F)F

Isomeric SMILES

C1=COC(=C1)CN(CCC#N)C(=S)NC2=CC=C(C=C2)OC(F)(F)F

InChI

InChI=1S/C16H14F3N3O2S/c17-16(18,19)24-13-6-4-12(5-7-13)21-15(25)22(9-2-8-20)11-14-3-1-10-23-14/h1,3-7,10H,2,9,11H2,(H,21,25)