diethyl 2-[(5-phenyl-2,3,4,5-tetrahydropyridin-6-yl)sulfanyl]propanedioate

Systemtic Name: diethyl 2-[(5-phenyl-2,3,4,5-tetrahydropyridin-6-yl)sulfanyl]propanedioate Openeye Name: diethyl 2-[(5-phenyl-2,3,4,5-tetrahydropyridin-6-yl)sulfanyl]propanedioate CAS Name: 2-[(5-phenyl-2,3,4,5-tetrahydropyridin-6-yl)thio]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(5-phenyl-2,3,4,5-tetrahydropyridin-6-yl)sulfanyl]propanedioate Traditional Name: 2-[(5-phenyl-2,3,4,5-tetrahydropyridin-6-yl)thio]malonic acid diethyl ester Formula: C18H23NO4S MolecularWeight: 349.44452

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OCC)SC1=NCCCC1C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(C(=O)OCC)SC1=NCCCC1C2=CC=CC=C2

InChI

InChI=1S/C18H23NO4S/c1-3-22-17(20)15(18(21)23-4-2)24-16-14(11-8-12-19-16)13-9-6-5-7-10-13/h5-7,9-10,14-15H,3-4,8,11-12H2,1-2H3