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

Systemtic Name: 2,4,6-trimethyl-2-(1-phenylsulfanylethyl)-5-propan-2-yloxycarbonyl-3,4-dihydro-1H-pyridine-3-carboxylate Openeye Name: 5-isopropoxycarbonyl-2,4,6-trimethyl-2-(1-phenylsulfanylethyl)-3,4-dihydro-1H-pyridine-3-carboxylate CAS Name: 2,4,6-trimethyl-5-[oxo(propan-2-yloxy)methyl]-2-[1-(phenylthio)ethyl]-3,4-dihydro-1H-pyridine-3-carboxylate IUPAC Name: 2,4,6-trimethyl-2-(1-phenylsulfanylethyl)-5-propan-2-yloxycarbonyl-3,4-dihydro-1H-pyridine-3-carboxylate Traditional Name: 5-isopropoxycarbonyl-2,4,6-trimethyl-2-[1-(phenylthio)ethyl]-3,4-dihydro-1H-pyridine-3-carboxylate Formula: C21H28NO4S- MolecularWeight: 390.51632

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(NC(=C1C(=O)OC(C)C)C)(C)C(C)SC2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CC1C(C(NC(=C1C(=O)OC(C)C)C)(C)C(C)SC2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C21H29NO4S/c1-12(2)26-20(25)17-13(3)18(19(23)24)21(6,22-14(17)4)15(5)27-16-10-8-7-9-11-16/h7-13,15,18,22H,1-6H3,(H,23,24)/p-1