2-methoxyethyl 5-cyano-4-(furan-2-yl)-2-methyl-6-phenacylsulfanyl-pyridine-3-carboxylate

Systemtic Name: 2-methoxyethyl 5-cyano-4-(furan-2-yl)-2-methyl-6-phenacylsulfanyl-pyridine-3-carboxylate Openeye Name: 2-methoxyethyl 5-cyano-4-(2-furyl)-2-methyl-6-phenacylsulfanyl-pyridine-3-carboxylate CAS Name: 5-cyano-4-(2-furanyl)-2-methyl-6-(phenacylthio)-3-pyridinecarboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 5-cyano-4-(furan-2-yl)-2-methyl-6-phenacylsulfanylpyridine-3-carboxylate Traditional Name: 5-cyano-4-(2-furyl)-2-methyl-6-(phenacylthio)nicotinic acid 2-methoxyethyl ester Formula: C23H20N2O5S MolecularWeight: 436.4803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=N1)SCC(=O)C2=CC=CC=C2)C#N)C3=CC=CO3)C(=O)OCCOC

Isomeric SMILES

CC1=C(C(=C(C(=N1)SCC(=O)C2=CC=CC=C2)C#N)C3=CC=CO3)C(=O)OCCOC

InChI

InChI=1S/C23H20N2O5S/c1-15-20(23(27)30-12-11-28-2)21(19-9-6-10-29-19)17(13-24)22(25-15)31-14-18(26)16-7-4-3-5-8-16/h3-10H,11-12,14H2,1-2H3