4-(3,5-dimethylphenoxy)-3-oxidanylidene-2-(4-phenyl-1,3-thiazol-2-yl)butanenitrile

Systemtic Name: 4-(3,5-dimethylphenoxy)-3-oxidanylidene-2-(4-phenyl-1,3-thiazol-2-yl)butanenitrile Openeye Name: 4-(3,5-dimethylphenoxy)-3-oxo-2-(4-phenylthiazol-2-yl)butanenitrile CAS Name: 4-(3,5-dimethylphenoxy)-3-oxo-2-(4-phenyl-2-thiazolyl)butanenitrile IUPAC Name: 4-(3,5-dimethylphenoxy)-3-oxo-2-(4-phenyl-1,3-thiazol-2-yl)butanenitrile Traditional Name: 4-(3,5-dimethylphenoxy)-3-keto-2-(4-phenylthiazol-2-yl)butyronitrile Formula: C21H18N2O2S MolecularWeight: 362.44482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)C(C#N)C2=NC(=CS2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)C(C#N)C2=NC(=CS2)C3=CC=CC=C3)C

InChI

InChI=1S/C21H18N2O2S/c1-14-8-15(2)10-17(9-14)25-12-20(24)18(11-22)21-23-19(13-26-21)16-6-4-3-5-7-16/h3-10,13,18H,12H2,1-2H3