methyl 2-(6-piperidin-1-ylpyrimidin-4-yl)sulfanylethanoate

Systemtic Name: methyl 2-(6-piperidin-1-ylpyrimidin-4-yl)sulfanylethanoate Openeye Name: methyl 2-[6-(1-piperidyl)pyrimidin-4-yl]sulfanylacetate CAS Name: 2-[[6-(1-piperidinyl)-4-pyrimidinyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-(6-piperidin-1-ylpyrimidin-4-yl)sulfanylacetate Traditional Name: 2-[(6-piperidinopyrimidin-4-yl)thio]acetic acid methyl ester Formula: C12H17N3O2S MolecularWeight: 267.34728

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NC=NC(=C1)N2CCCCC2

Isomeric SMILES

COC(=O)CSC1=NC=NC(=C1)N2CCCCC2

InChI

InChI=1S/C12H17N3O2S/c1-17-12(16)8-18-11-7-10(13-9-14-11)15-5-3-2-4-6-15/h7,9H,2-6,8H2,1H3