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

Systemtic Name: 4-(4-methylphenoxy)-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-butanenitrile Openeye Name: 4-(4-methylphenoxy)-3-oxo-2-[4-(p-tolyl)thiazol-2-yl]butanenitrile CAS Name: 4-(4-methylphenoxy)-2-[4-(4-methylphenyl)-2-thiazolyl]-3-oxobutanenitrile IUPAC Name: 4-(4-methylphenoxy)-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-oxobutanenitrile Traditional Name: 3-keto-4-(4-methylphenoxy)-2-[4-(p-tolyl)thiazol-2-yl]butyronitrile Formula: C21H18N2O2S MolecularWeight: 362.44482

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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