1-(1,3-benzodioxol-5-ylmethyl)-3-[4-(trifluoromethyloxy)phenyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[4-(trifluoromethyloxy)phenyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[4-(trifluoromethoxy)phenyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[4-(trifluoromethoxy)phenyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[4-(trifluoromethoxy)phenyl]thiourea Traditional Name: 1-piperonyl-3-[4-(trifluoromethoxy)phenyl]thiourea Formula: C16H13F3N2O3S MolecularWeight: 370.34623

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=S)NC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=S)NC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C16H13F3N2O3S/c17-16(18,19)24-12-4-2-11(3-5-12)21-15(25)20-8-10-1-6-13-14(7-10)23-9-22-13/h1-7H,8-9H2,(H2,20,21,25)