5-(4-chloranyl-3-methyl-phenoxy)-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-pentanenitrile

Systemtic Name: 5-(4-chloranyl-3-methyl-phenoxy)-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-pentanenitrile Openeye Name: 5-(4-chloro-3-methyl-phenoxy)-3-oxo-2-[4-(p-tolyl)thiazol-2-yl]pentanenitrile CAS Name: 5-(4-chloro-3-methylphenoxy)-2-[4-(4-methylphenyl)-2-thiazolyl]-3-oxopentanenitrile IUPAC Name: 5-(4-chloro-3-methylphenoxy)-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-oxopentanenitrile Traditional Name: 5-(4-chloro-3-methyl-phenoxy)-3-keto-2-[4-(p-tolyl)thiazol-2-yl]valeronitrile Formula: C22H19ClN2O2S MolecularWeight: 410.91646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)C(C#N)C(=O)CCOC3=CC(=C(C=C3)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)C(C#N)C(=O)CCOC3=CC(=C(C=C3)Cl)C

InChI

InChI=1S/C22H19ClN2O2S/c1-14-3-5-16(6-4-14)20-13-28-22(25-20)18(12-24)21(26)9-10-27-17-7-8-19(23)15(2)11-17/h3-8,11,13,18H,9-10H2,1-2H3