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

Systemtic Name: 4-[4-(4-methylphenyl)phenoxy]-3-oxidanylidene-2-(4-phenyl-1,3-thiazol-2-yl)butanenitrile Openeye Name: 3-oxo-2-(4-phenylthiazol-2-yl)-4-[4-(p-tolyl)phenoxy]butanenitrile CAS Name: 4-[4-(4-methylphenyl)phenoxy]-3-oxo-2-(4-phenyl-2-thiazolyl)butanenitrile IUPAC Name: 4-[4-(4-methylphenyl)phenoxy]-3-oxo-2-(4-phenyl-1,3-thiazol-2-yl)butanenitrile Traditional Name: 3-keto-2-(4-phenylthiazol-2-yl)-4-[4-(p-tolyl)phenoxy]butyronitrile Formula: C26H20N2O2S MolecularWeight: 424.5142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=C(C=C2)OCC(=O)C(C#N)C3=NC(=CS3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=C(C=C2)OCC(=O)C(C#N)C3=NC(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C26H20N2O2S/c1-18-7-9-19(10-8-18)20-11-13-22(14-12-20)30-16-25(29)23(15-27)26-28-24(17-31-26)21-5-3-2-4-6-21/h2-14,17,23H,16H2,1H3