3-(3-chloranyl-5-ethoxy-4-propoxy-phenyl)-2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-propanenitrile

Systemtic Name: 3-(3-chloranyl-5-ethoxy-4-propoxy-phenyl)-2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-propanenitrile Openeye Name: 3-(3-chloro-5-ethoxy-4-propoxy-phenyl)-2-(4-methylthiazol-2-yl)-3-oxo-propanenitrile CAS Name: 3-(3-chloro-5-ethoxy-4-propoxyphenyl)-2-(4-methyl-2-thiazolyl)-3-oxopropanenitrile IUPAC Name: 3-(3-chloro-5-ethoxy-4-propoxyphenyl)-2-(4-methyl-1,3-thiazol-2-yl)-3-oxopropanenitrile Traditional Name: 3-(3-chloro-5-ethoxy-4-propoxy-phenyl)-3-keto-2-(4-methylthiazol-2-yl)propionitrile Formula: C18H19ClN2O3S MolecularWeight: 378.87306

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C(=O)C(C#N)C2=NC(=CS2)C)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)C(=O)C(C#N)C2=NC(=CS2)C)OCC

InChI

InChI=1S/C18H19ClN2O3S/c1-4-6-24-17-14(19)7-12(8-15(17)23-5-2)16(22)13(9-20)18-21-11(3)10-25-18/h7-8,10,13H,4-6H2,1-3H3