diethyl 2-[2-(4-chloranylpyridin-2-yl)-1-[(4-methoxyphenyl)methylsulfanyl]butylidene]propanedioate

Systemtic Name: diethyl 2-[2-(4-chloranylpyridin-2-yl)-1-[(4-methoxyphenyl)methylsulfanyl]butylidene]propanedioate Openeye Name: diethyl 2-[2-(4-chloro-2-pyridyl)-1-[(4-methoxyphenyl)methylsulfanyl]butylidene]propanedioate CAS Name: 2-[2-(4-chloro-2-pyridinyl)-1-[(4-methoxyphenyl)methylthio]butylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[2-(4-chloropyridin-2-yl)-1-[(4-methoxyphenyl)methylsulfanyl]butylidene]propanedioate Traditional Name: 2-[2-(4-chloro-2-pyridyl)-1-(p-anisylthio)butylidene]malonic acid diethyl ester Formula: C24H28ClNO5S MolecularWeight: 478.00082

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC=CC(=C1)Cl)C(=C(C(=O)OCC)C(=O)OCC)SCC2=CC=C(C=C2)OC

Isomeric SMILES

CCC(C1=NC=CC(=C1)Cl)C(=C(C(=O)OCC)C(=O)OCC)SCC2=CC=C(C=C2)OC

InChI

InChI=1S/C24H28ClNO5S/c1-5-19(20-14-17(25)12-13-26-20)22(21(23(27)30-6-2)24(28)31-7-3)32-15-16-8-10-18(29-4)11-9-16/h8-14,19H,5-7,15H2,1-4H3