N-[3-[bis(fluoranyl)methoxy]-4-methoxy-phenyl]thian-4-amine

Systemtic Name: N-[3-[bis(fluoranyl)methoxy]-4-methoxy-phenyl]thian-4-amine Openeye Name: N-[3-(difluoromethoxy)-4-methoxy-phenyl]tetrahydrothiopyran-4-amine CAS Name: N-[3-(difluoromethoxy)-4-methoxyphenyl]-4-thianamine IUPAC Name: N-[3-(difluoromethoxy)-4-methoxyphenyl]thian-4-amine Traditional Name: [3-(difluoromethoxy)-4-methoxy-phenyl]-tetrahydrothiopyran-4-yl-amine Formula: C13H17F2NO2S MolecularWeight: 289.341386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2CCSCC2)OC(F)F

Isomeric SMILES

COC1=C(C=C(C=C1)NC2CCSCC2)OC(F)F

InChI

InChI=1S/C13H17F2NO2S/c1-17-11-3-2-10(8-12(11)18-13(14)15)16-9-4-6-19-7-5-9/h2-3,8-9,13,16H,4-7H2,1H3