5-ethoxycarbonyl-2,4,6-trimethyl-3-(2-phenylsulfanylethyl)-2,4-dihydro-1H-pyridine-3-carboxylate

Systemtic Name: 5-ethoxycarbonyl-2,4,6-trimethyl-3-(2-phenylsulfanylethyl)-2,4-dihydro-1H-pyridine-3-carboxylate Openeye Name: 5-ethoxycarbonyl-2,4,6-trimethyl-3-(2-phenylsulfanylethyl)-2,4-dihydro-1H-pyridine-3-carboxylate CAS Name: 5-ethoxycarbonyl-2,4,6-trimethyl-3-[2-(phenylthio)ethyl]-2,4-dihydro-1H-pyridine-3-carboxylate IUPAC Name: 5-ethoxycarbonyl-2,4,6-trimethyl-3-(2-phenylsulfanylethyl)-2,4-dihydro-1H-pyridine-3-carboxylate Traditional Name: 5-carbethoxy-2,4,6-trimethyl-3-[2-(phenylthio)ethyl]-2,4-dihydro-1H-pyridine-3-carboxylate Formula: C20H26NO4S- MolecularWeight: 376.48974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(C(C1C)(CCSC2=CC=CC=C2)C(=O)[O-])C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(C(C1C)(CCSC2=CC=CC=C2)C(=O)[O-])C)C

InChI

InChI=1S/C20H27NO4S/c1-5-25-18(22)17-13(2)20(19(23)24,15(4)21-14(17)3)11-12-26-16-9-7-6-8-10-16/h6-10,13,15,21H,5,11-12H2,1-4H3,(H,23,24)/p-1