2-methoxyethyl 5-cyano-4-(furan-2-yl)-2-methyl-6-[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl]sulfanyl-pyridine-3-carboxylate

Systemtic Name: 2-methoxyethyl 5-cyano-4-(furan-2-yl)-2-methyl-6-[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl]sulfanyl-pyridine-3-carboxylate Openeye Name: 2-methoxyethyl 5-cyano-4-(2-furyl)-2-methyl-6-[2-(1-naphthylamino)-2-oxo-ethyl]sulfanyl-pyridine-3-carboxylate CAS Name: 5-cyano-4-(2-furanyl)-2-methyl-6-[[2-(1-naphthalenylamino)-2-oxoethyl]thio]-3-pyridinecarboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 5-cyano-4-(furan-2-yl)-2-methyl-6-[2-(naphthalen-1-ylamino)-2-oxoethyl]sulfanylpyridine-3-carboxylate Traditional Name: 5-cyano-4-(2-furyl)-6-[[2-keto-2-(1-naphthylamino)ethyl]thio]-2-methyl-nicotinic acid 2-methoxyethyl ester Formula: C27H23N3O5S MolecularWeight: 501.55362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=N1)SCC(=O)NC2=CC=CC3=CC=CC=C32)C#N)C4=CC=CO4)C(=O)OCCOC

Isomeric SMILES

CC1=C(C(=C(C(=N1)SCC(=O)NC2=CC=CC3=CC=CC=C32)C#N)C4=CC=CO4)C(=O)OCCOC

InChI

InChI=1S/C27H23N3O5S/c1-17-24(27(32)35-14-13-33-2)25(22-11-6-12-34-22)20(15-28)26(29-17)36-16-23(31)30-21-10-5-8-18-7-3-4-9-19(18)21/h3-12H,13-14,16H2,1-2H3,(H,30,31)