methyl 3-(2-ethoxy-2-oxidanylidene-ethyl)-2-methyl-6-methylsulfanyl-4-thiophen-2-yl-benzoate

Systemtic Name: methyl 3-(2-ethoxy-2-oxidanylidene-ethyl)-2-methyl-6-methylsulfanyl-4-thiophen-2-yl-benzoate Openeye Name: methyl 3-(2-ethoxy-2-oxo-ethyl)-2-methyl-6-methylsulfanyl-4-(2-thienyl)benzoate CAS Name: 3-(2-ethoxy-2-oxoethyl)-2-methyl-6-(methylthio)-4-thiophen-2-ylbenzoic acid methyl ester IUPAC Name: methyl 3-(2-ethoxy-2-oxoethyl)-2-methyl-6-methylsulfanyl-4-thiophen-2-ylbenzoate Traditional Name: 3-(2-ethoxy-2-keto-ethyl)-2-methyl-6-(methylthio)-4-(2-thienyl)benzoic acid methyl ester Formula: C18H20O4S2 MolecularWeight: 364.479

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(C(=C(C=C1C2=CC=CS2)SC)C(=O)OC)C

Isomeric SMILES

CCOC(=O)CC1=C(C(=C(C=C1C2=CC=CS2)SC)C(=O)OC)C

InChI

InChI=1S/C18H20O4S2/c1-5-22-16(19)10-12-11(2)17(18(20)21-3)15(23-4)9-13(12)14-7-6-8-24-14/h6-9H,5,10H2,1-4H3