methyl 3-(3-azanylpyridin-4-yl)sulfanylpropanoate

Systemtic Name: methyl 3-(3-azanylpyridin-4-yl)sulfanylpropanoate Openeye Name: methyl 3-[(3-amino-4-pyridyl)sulfanyl]propanoate CAS Name: 3-[(3-amino-4-pyridinyl)thio]propanoic acid methyl ester IUPAC Name: methyl 3-(3-aminopyridin-4-yl)sulfanylpropanoate Traditional Name: 3-[(3-amino-4-pyridyl)thio]propionic acid methyl ester Formula: C9H12N2O2S MolecularWeight: 212.26878

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSC1=C(C=NC=C1)N

Isomeric SMILES

COC(=O)CCSC1=C(C=NC=C1)N

InChI

InChI=1S/C9H12N2O2S/c1-13-9(12)3-5-14-8-2-4-11-6-7(8)10/h2,4,6H,3,5,10H2,1H3