methyl 5-[(3-azanylpyridin-4-yl)sulfanylmethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[(3-azanylpyridin-4-yl)sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 5-[(3-amino-4-pyridyl)sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[(3-amino-4-pyridinyl)thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(3-aminopyridin-4-yl)sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[(3-amino-4-pyridyl)thio]methyl]furan-2-carboxylic acid methyl ester Formula: C12H12N2O3S MolecularWeight: 264.30028

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)CSC2=C(C=NC=C2)N

Isomeric SMILES

COC(=O)C1=CC=C(O1)CSC2=C(C=NC=C2)N

InChI

InChI=1S/C12H12N2O3S/c1-16-12(15)10-3-2-8(17-10)7-18-11-4-5-14-6-9(11)13/h2-6H,7,13H2,1H3