N-[(5-ethylthiophen-2-yl)methyl]-2,2-bis(fluoranyl)-1,3-benzodioxol-5-amine

Systemtic Name: N-[(5-ethylthiophen-2-yl)methyl]-2,2-bis(fluoranyl)-1,3-benzodioxol-5-amine Openeye Name: N-[(5-ethyl-2-thienyl)methyl]-2,2-difluoro-1,3-benzodioxol-5-amine CAS Name: N-[(5-ethyl-2-thiophenyl)methyl]-2,2-difluoro-1,3-benzodioxol-5-amine IUPAC Name: N-[(5-ethylthiophen-2-yl)methyl]-2,2-difluoro-1,3-benzodioxol-5-amine Traditional Name: (2,2-difluoro-1,3-benzodioxol-5-yl)-[(5-ethyl-2-thienyl)methyl]amine Formula: C14H13F2NO2S MolecularWeight: 297.320326

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)CNC2=CC3=C(C=C2)OC(O3)(F)F

Isomeric SMILES

CCC1=CC=C(S1)CNC2=CC3=C(C=C2)OC(O3)(F)F

InChI

InChI=1S/C14H13F2NO2S/c1-2-10-4-5-11(20-10)8-17-9-3-6-12-13(7-9)19-14(15,16)18-12/h3-7,17H,2,8H2,1H3