3-(8-fluoranyl-1-methyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)-3-oxidanylidene-2-(phenylsulfonyl)propanenitrile

Systemtic Name: 3-(8-fluoranyl-1-methyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)-3-oxidanylidene-2-(phenylsulfonyl)propanenitrile Openeye Name: 2-(benzenesulfonyl)-3-(8-fluoro-1-methyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)-3-oxo-propanenitrile CAS Name: 2-(benzenesulfonyl)-3-(8-fluoro-1-methyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)-3-oxopropanenitrile IUPAC Name: 2-(benzenesulfonyl)-3-(8-fluoro-1-methyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)-3-oxopropanenitrile Traditional Name: 2-besyl-3-(8-fluoro-1-methyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)-3-keto-propionitrile Formula: C20H14FN3O3S2 MolecularWeight: 427.471863

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CSC3=C2C=C(C=C3)F)C(=N1)C(=O)C(C#N)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CN1C2=C(CSC3=C2C=C(C=C3)F)C(=N1)C(=O)C(C#N)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H14FN3O3S2/c1-24-19-14-9-12(21)7-8-16(14)28-11-15(19)18(23-24)20(25)17(10-22)29(26,27)13-5-3-2-4-6-13/h2-9,17H,11H2,1H3