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

Systemtic Name: 4-(4-chloranyl-2-methyl-phenoxy)-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-butanenitrile Openeye Name: 4-(4-chloro-2-methyl-phenoxy)-3-oxo-2-[4-(p-tolyl)thiazol-2-yl]butanenitrile CAS Name: 4-(4-chloro-2-methylphenoxy)-2-[4-(4-methylphenyl)-2-thiazolyl]-3-oxobutanenitrile IUPAC Name: 4-(4-chloro-2-methylphenoxy)-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-oxobutanenitrile Traditional Name: 4-(4-chloro-2-methyl-phenoxy)-3-keto-2-[4-(p-tolyl)thiazol-2-yl]butyronitrile Formula: C21H17ClN2O2S MolecularWeight: 396.88988

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17ClN2O2S/c1-13-3-5-15(6-4-13)18-12-27-21(24-18)17(10-23)19(25)11-26-20-8-7-16(22)9-14(20)2/h3-9,12,17H,11H2,1-2H3