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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(OC=C1)CSC2=C(C=NC=C2)N

Isomeric SMILES

COC(=O)C1=C(OC=C1)CSC2=C(C=NC=C2)N

InChI

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