2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-4-(4-propanoylphenoxy)butanenitrile

Systemtic Name: 2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-4-(4-propanoylphenoxy)butanenitrile Openeye Name: 2-(4-methylthiazol-2-yl)-3-oxo-4-(4-propanoylphenoxy)butanenitrile CAS Name: 2-(4-methyl-2-thiazolyl)-3-oxo-4-[4-(1-oxopropyl)phenoxy]butanenitrile IUPAC Name: 2-(4-methyl-1,3-thiazol-2-yl)-3-oxo-4-(4-propanoylphenoxy)butanenitrile Traditional Name: 3-keto-2-(4-methylthiazol-2-yl)-4-(4-propionylphenoxy)butyronitrile Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O3S/c1-3-15(20)12-4-6-13(7-5-12)22-9-16(21)14(8-18)17-19-11(2)10-23-17/h4-7,10,14H,3,9H2,1-2H3