methyl 5-[(6-piperidin-1-ylpyrimidin-4-yl)sulfanylmethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[(6-piperidin-1-ylpyrimidin-4-yl)sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 5-[[6-(1-piperidyl)pyrimidin-4-yl]sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[[6-(1-piperidinyl)-4-pyrimidinyl]thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(6-piperidin-1-ylpyrimidin-4-yl)sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[(6-piperidinopyrimidin-4-yl)thio]methyl]furan-2-carboxylic acid methyl ester Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)CSC2=NC=NC(=C2)N3CCCCC3

Isomeric SMILES

COC(=O)C1=CC=C(O1)CSC2=NC=NC(=C2)N3CCCCC3

InChI

InChI=1S/C16H19N3O3S/c1-21-16(20)13-6-5-12(22-13)10-23-15-9-14(17-11-18-15)19-7-3-2-4-8-19/h5-6,9,11H,2-4,7-8,10H2,1H3