O5-ethyl O3-(phenylmethyl) 4-[3-(2-methoxy-2-oxidanylidene-ethyl)sulfanylthiophen-2-yl]-2,6-dimethyl-pyridine-3,5-dicarboxylate

Systemtic Name: O5-ethyl O3-(phenylmethyl) 4-[3-(2-methoxy-2-oxidanylidene-ethyl)sulfanylthiophen-2-yl]-2,6-dimethyl-pyridine-3,5-dicarboxylate Openeye Name: O3-benzyl O5-ethyl 4-[3-(2-methoxy-2-oxo-ethyl)sulfanyl-2-thienyl]-2,6-dimethyl-pyridine-3,5-dicarboxylate CAS Name: 4-[3-[(2-methoxy-2-oxoethyl)thio]-2-thiophenyl]-2,6-dimethylpyridine-3,5-dicarboxylic acid O5-ethyl ester O3-(phenylmethyl) ester IUPAC Name: 3-O-benzyl 5-O-ethyl 4-[3-(2-methoxy-2-oxoethyl)sulfanylthiophen-2-yl]-2,6-dimethylpyridine-3,5-dicarboxylate Traditional Name: 4-[3-[(2-keto-2-methoxy-ethyl)thio]-2-thienyl]-2,6-dimethyl-pyridine-3,5-dicarboxylic acid O3-benzyl ester O5-ethyl ester Formula: C25H25NO6S2 MolecularWeight: 499.5991

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1C2=C(C=CS2)SCC(=O)OC)C(=O)OCC3=CC=CC=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1C2=C(C=CS2)SCC(=O)OC)C(=O)OCC3=CC=CC=C3)C)C

InChI

InChI=1S/C25H25NO6S2/c1-5-31-24(28)20-15(2)26-16(3)21(25(29)32-13-17-9-7-6-8-10-17)22(20)23-18(11-12-33-23)34-14-19(27)30-4/h6-12H,5,13-14H2,1-4H3