methyl (2R)-4-[2-(4-pyridin-2-ylpiperazin-1-yl)ethanoyl]thiomorpholine-2-carboxylate

Systemtic Name: methyl (2R)-4-[2-(4-pyridin-2-ylpiperazin-1-yl)ethanoyl]thiomorpholine-2-carboxylate Openeye Name: methyl (2R)-4-[2-[4-(2-pyridyl)piperazin-1-yl]acetyl]thiomorpholine-2-carboxylate CAS Name: (2R)-4-[1-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl]-2-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-4-[2-(4-pyridin-2-ylpiperazin-1-yl)acetyl]thiomorpholine-2-carboxylate Traditional Name: (2R)-4-[2-[4-(2-pyridyl)piperazino]acetyl]thiomorpholine-2-carboxylic acid methyl ester Formula: C17H24N4O3S MolecularWeight: 364.46246

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(CCS1)C(=O)CN2CCN(CC2)C3=CC=CC=N3

Isomeric SMILES

COC(=O)[C@H]1CN(CCS1)C(=O)CN2CCN(CC2)C3=CC=CC=N3

InChI

InChI=1S/C17H24N4O3S/c1-24-17(23)14-12-21(10-11-25-14)16(22)13-19-6-8-20(9-7-19)15-4-2-3-5-18-15/h2-5,14H,6-13H2,1H3/t14-/m1/s1