O3-methyl O5-(2-phenylsulfanylethyl) (4S)-2,4,6-trimethyl-3,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-methyl O5-(2-phenylsulfanylethyl) (4S)-2,4,6-trimethyl-3,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-methyl O5-(2-phenylsulfanylethyl) (4S)-2,4,6-trimethyl-3,4-dihydropyridine-3,5-dicarboxylate CAS Name: (4S)-2,4,6-trimethyl-3,4-dihydropyridine-3,5-dicarboxylic acid O3-methyl ester O5-[2-(phenylthio)ethyl] ester IUPAC Name: 3-O-methyl 5-O-(2-phenylsulfanylethyl) (4S)-2,4,6-trimethyl-3,4-dihydropyridine-3,5-dicarboxylate Traditional Name: (4S)-2,4,6-trimethyl-3,4-dihydropyridine-3,5-dicarboxylic acid O3-methyl ester O5-[2-(phenylthio)ethyl] ester Formula: C19H23NO4S MolecularWeight: 361.45522

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=NC(=C1C(=O)OCCSC2=CC=CC=C2)C)C)C(=O)OC

Isomeric SMILES

C[C@H]1C(C(=NC(=C1C(=O)OCCSC2=CC=CC=C2)C)C)C(=O)OC

InChI

InChI=1S/C19H23NO4S/c1-12-16(18(21)23-4)13(2)20-14(3)17(12)19(22)24-10-11-25-15-8-6-5-7-9-15/h5-9,12,16H,10-11H2,1-4H3/t12-,16?/m0/s1