1-(1,3-benzodioxol-5-ylmethyl)-3-(3-chloranyl-2-fluoranyl-phenyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(3-chloranyl-2-fluoranyl-phenyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(3-chloro-2-fluoro-phenyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(3-chloro-2-fluorophenyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(3-chloro-2-fluorophenyl)thiourea Traditional Name: 1-(3-chloro-2-fluoro-phenyl)-3-piperonyl-thiourea Formula: C15H12ClFN2O2S MolecularWeight: 338.784383

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12ClFN2O2S/c16-10-2-1-3-11(14(10)17)19-15(22)18-7-9-4-5-12-13(6-9)21-8-20-12/h1-6H,7-8H2,(H2,18,19,22)