2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-4-(4-propylphenoxy)butanenitrile

Systemtic Name: 2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-4-(4-propylphenoxy)butanenitrile Openeye Name: 3-oxo-4-(4-propylphenoxy)-2-[4-(p-tolyl)thiazol-2-yl]butanenitrile CAS Name: 2-[4-(4-methylphenyl)-2-thiazolyl]-3-oxo-4-(4-propylphenoxy)butanenitrile IUPAC Name: 2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-oxo-4-(4-propylphenoxy)butanenitrile Traditional Name: 3-keto-4-(4-propylphenoxy)-2-[4-(p-tolyl)thiazol-2-yl]butyronitrile Formula: C23H22N2O2S MolecularWeight: 390.49798

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OCC(=O)C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)C

Isomeric SMILES

CCCC1=CC=C(C=C1)OCC(=O)C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)C

InChI

InChI=1S/C23H22N2O2S/c1-3-4-17-7-11-19(12-8-17)27-14-22(26)20(13-24)23-25-21(15-28-23)18-9-5-16(2)6-10-18/h5-12,15,20H,3-4,14H2,1-2H3