(2S)-3-oxidanylidene-2-(5-phenyl-1,3,4-thiadiazol-2-yl)butanenitrile

Systemtic Name: (2S)-3-oxidanylidene-2-(5-phenyl-1,3,4-thiadiazol-2-yl)butanenitrile Openeye Name: (2S)-3-oxo-2-(5-phenyl-1,3,4-thiadiazol-2-yl)butanenitrile CAS Name: (2S)-3-oxo-2-(5-phenyl-1,3,4-thiadiazol-2-yl)butanenitrile IUPAC Name: (2S)-3-oxo-2-(5-phenyl-1,3,4-thiadiazol-2-yl)butanenitrile Traditional Name: (2S)-3-keto-2-(5-phenyl-1,3,4-thiadiazol-2-yl)butyronitrile Formula: C12H9N3OS MolecularWeight: 243.28436

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C#N)C1=NN=C(S1)C2=CC=CC=C2

Isomeric SMILES

CC(=O)[C@H](C#N)C1=NN=C(S1)C2=CC=CC=C2

InChI

InChI=1S/C12H9N3OS/c1-8(16)10(7-13)12-15-14-11(17-12)9-5-3-2-4-6-9/h2-6,10H,1H3/t10-/m0/s1