methyl 1-[2-(6-azanylpyridin-3-yl)sulfanylethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-(6-azanylpyridin-3-yl)sulfanylethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-[(6-amino-3-pyridyl)sulfanyl]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[(6-amino-3-pyridinyl)thio]-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(6-aminopyridin-3-yl)sulfanylacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(6-amino-3-pyridyl)thio]acetyl]isonipecotic acid methyl ester Formula: C14H19N3O3S MolecularWeight: 309.38396

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)CSC2=CN=C(C=C2)N

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)CSC2=CN=C(C=C2)N

InChI

InChI=1S/C14H19N3O3S/c1-20-14(19)10-4-6-17(7-5-10)13(18)9-21-11-2-3-12(15)16-8-11/h2-3,8,10H,4-7,9H2,1H3,(H2,15,16)