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

Systemtic Name: 2-[(8-fluoranyl-1-methyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)carbonyl]-3-oxidanylidene-3-phenyl-propanenitrile Openeye Name: 2-benzoyl-3-(8-fluoro-1-methyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)-3-oxo-propanenitrile CAS Name: 2-benzoyl-3-(8-fluoro-1-methyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)-3-oxopropanenitrile IUPAC Name: 2-benzoyl-3-(8-fluoro-1-methyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)-3-oxopropanenitrile Traditional Name: 2-benzoyl-3-(8-fluoro-1-methyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)-3-keto-propionitrile Formula: C21H14FN3O2S MolecularWeight: 391.418163

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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)C(=O)C4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C21H14FN3O2S/c1-25-19-14-9-13(22)7-8-17(14)28-11-16(19)18(24-25)21(27)15(10-23)20(26)12-5-3-2-4-6-12/h2-9,15H,11H2,1H3