4-(3,5-dimethylphenoxy)-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-butanenitrile

Systemtic Name: 4-(3,5-dimethylphenoxy)-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-butanenitrile Openeye Name: 4-(3,5-dimethylphenoxy)-3-oxo-2-[4-(p-tolyl)thiazol-2-yl]butanenitrile CAS Name: 4-(3,5-dimethylphenoxy)-2-[4-(4-methylphenyl)-2-thiazolyl]-3-oxobutanenitrile IUPAC Name: 4-(3,5-dimethylphenoxy)-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-oxobutanenitrile Traditional Name: 4-(3,5-dimethylphenoxy)-3-keto-2-[4-(p-tolyl)thiazol-2-yl]butyronitrile Formula: C22H20N2O2S MolecularWeight: 376.4714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)C(C#N)C(=O)COC3=CC(=CC(=C3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)C(C#N)C(=O)COC3=CC(=CC(=C3)C)C

InChI

InChI=1S/C22H20N2O2S/c1-14-4-6-17(7-5-14)20-13-27-22(24-20)19(11-23)21(25)12-26-18-9-15(2)8-16(3)10-18/h4-10,13,19H,12H2,1-3H3