(2S)-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-butanenitrile

Systemtic Name: (2S)-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-butanenitrile Openeye Name: (2S)-2-[4-(4-fluorophenyl)thiazol-2-yl]-3-oxo-butanenitrile CAS Name: (2S)-2-[4-(4-fluorophenyl)-2-thiazolyl]-3-oxobutanenitrile IUPAC Name: (2S)-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-oxobutanenitrile Traditional Name: (2S)-2-[4-(4-fluorophenyl)thiazol-2-yl]-3-keto-butyronitrile Formula: C13H9FN2OS MolecularWeight: 260.286763

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C#N)C1=NC(=CS1)C2=CC=C(C=C2)F

Isomeric SMILES

CC(=O)[C@H](C#N)C1=NC(=CS1)C2=CC=C(C=C2)F

InChI

InChI=1S/C13H9FN2OS/c1-8(17)11(6-15)13-16-12(7-18-13)9-2-4-10(14)5-3-9/h2-5,7,11H,1H3/t11-/m0/s1