ethyl 1-[2-(4-methylpyrimidin-2-yl)sulfanylethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(4-methylpyrimidin-2-yl)sulfanylethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(4-methylpyrimidin-2-yl)sulfanylacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[(4-methyl-2-pyrimidinyl)thio]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-methylpyrimidin-2-yl)sulfanylacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(4-methylpyrimidin-2-yl)thio]acetyl]isonipecotic acid ethyl ester Formula: C15H21N3O3S MolecularWeight: 323.41054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CSC2=NC=CC(=N2)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CSC2=NC=CC(=N2)C

InChI

InChI=1S/C15H21N3O3S/c1-3-21-14(20)12-5-8-18(9-6-12)13(19)10-22-15-16-7-4-11(2)17-15/h4,7,12H,3,5-6,8-10H2,1-2H3