1-(1,3-benzodioxol-5-ylmethyl)-3-[[2-(trifluoromethyl)phenyl]amino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[2-(trifluoromethyl)phenyl]amino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(trifluoromethyl)anilino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(trifluoromethyl)anilino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(trifluoromethyl)anilino]thiourea Traditional Name: 1-piperonyl-3-[2-(trifluoromethyl)anilino]thiourea Formula: C16H14F3N3O2S MolecularWeight: 369.36147

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=S)NNC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=S)NNC3=CC=CC=C3C(F)(F)F

InChI

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