[2-[furan-2-ylmethyl(methyl)amino]-2-oxidanylidene-ethyl] 2-methylsulfanylpyridine-3-carboxylate

Systemtic Name: [2-[furan-2-ylmethyl(methyl)amino]-2-oxidanylidene-ethyl] 2-methylsulfanylpyridine-3-carboxylate Openeye Name: [2-[2-furylmethyl(methyl)amino]-2-oxo-ethyl] 2-methylsulfanylpyridine-3-carboxylate CAS Name: 2-(methylthio)-3-pyridinecarboxylic acid [2-[2-furanylmethyl(methyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[furan-2-ylmethyl(methyl)amino]-2-oxoethyl] 2-methylsulfanylpyridine-3-carboxylate Traditional Name: 2-(methylthio)nicotinic acid [2-[2-furfuryl(methyl)amino]-2-keto-ethyl] ester Formula: C15H16N2O4S MolecularWeight: 320.36354

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CO1)C(=O)COC(=O)C2=C(N=CC=C2)SC

Isomeric SMILES

CN(CC1=CC=CO1)C(=O)COC(=O)C2=C(N=CC=C2)SC

InChI

InChI=1S/C15H16N2O4S/c1-17(9-11-5-4-8-20-11)13(18)10-21-15(19)12-6-3-7-16-14(12)22-2/h3-8H,9-10H2,1-2H3