O5-(oxolan-2-ylmethyl) O3-(2-phenylsulfanylethyl) 2,4,6-trimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O5-(oxolan-2-ylmethyl) O3-(2-phenylsulfanylethyl) 2,4,6-trimethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-(2-phenylsulfanylethyl) O5-(tetrahydrofuran-2-ylmethyl) 2,4,6-trimethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,4,6-trimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O5-(2-oxolanylmethyl) ester O3-[2-(phenylthio)ethyl] ester IUPAC Name: 5-O-(oxolan-2-ylmethyl) 3-O-(2-phenylsulfanylethyl) 2,4,6-trimethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,4,6-trimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O3-[2-(phenylthio)ethyl] ester O5-(tetrahydrofurfuryl) ester Formula: C23H29NO5S MolecularWeight: 431.54506

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=C(NC(=C1C(=O)OCC2CCCO2)C)C)C(=O)OCCSC3=CC=CC=C3

Isomeric SMILES

CC1C(=C(NC(=C1C(=O)OCC2CCCO2)C)C)C(=O)OCCSC3=CC=CC=C3

InChI

InChI=1S/C23H29NO5S/c1-15-20(22(25)28-12-13-30-19-9-5-4-6-10-19)16(2)24-17(3)21(15)23(26)29-14-18-8-7-11-27-18/h4-6,9-10,15,18,24H,7-8,11-14H2,1-3H3