N-[6-fluoranyl-1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromen-4-yl]-1-methyl-pyrazol-4-amine

Systemtic Name: N-[6-fluoranyl-1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromen-4-yl]-1-methyl-pyrazol-4-amine Openeye Name: N-(6-fluoro-1,1-dioxo-3,4-dihydro-2H-thiochromen-4-yl)-1-methyl-pyrazol-4-amine CAS Name: N-(6-fluoro-1,1-dioxo-3,4-dihydro-2H-1-benzothiopyran-4-yl)-1-methyl-4-pyrazolamine IUPAC Name: N-(6-fluoro-1,1-dioxo-3,4-dihydro-2H-thiochromen-4-yl)-1-methylpyrazol-4-amine Traditional Name: (6-fluoro-1,1-diketo-3,4-dihydro-2H-thiochromen-4-yl)-(1-methylpyrazol-4-yl)amine Formula: C13H14FN3O2S MolecularWeight: 295.332563

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)NC2CCS(=O)(=O)C3=C2C=C(C=C3)F

Isomeric SMILES

CN1C=C(C=N1)NC2CCS(=O)(=O)C3=C2C=C(C=C3)F

InChI

InChI=1S/C13H14FN3O2S/c1-17-8-10(7-15-17)16-12-4-5-20(18,19)13-3-2-9(14)6-11(12)13/h2-3,6-8,12,16H,4-5H2,1H3