O3,O5-diethyl 2,6-dimethyl-4-pyridin-3-yl-1,4-dihydropyridine-3,5-dicarbothioate

Systemtic Name: O3,O5-diethyl 2,6-dimethyl-4-pyridin-3-yl-1,4-dihydropyridine-3,5-dicarbothioate Openeye Name: O3,O5-diethyl 2,6-dimethyl-4-(3-pyridyl)-1,4-dihydropyridine-3,5-dicarbothioate CAS Name: 2,6-dimethyl-4-(3-pyridinyl)-1,4-dihydropyridine-3,5-dicarbothioic acid O3,O5-diethyl ester IUPAC Name: 3-O,5-O-diethyl 2,6-dimethyl-4-pyridin-3-yl-1,4-dihydropyridine-3,5-dicarbothioate Traditional Name: 2,6-dimethyl-4-(3-pyridyl)-1,4-dihydropyridine-3,5-dicarbothioic acid O3,O5-diethyl ester Formula: C18H22N2O2S2 MolecularWeight: 362.50948

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=S)C1=C(NC(=C(C1C2=CN=CC=C2)C(=S)OCC)C)C

Isomeric SMILES

CCOC(=S)C1=C(NC(=C(C1C2=CN=CC=C2)C(=S)OCC)C)C

InChI

InChI=1S/C18H22N2O2S2/c1-5-21-17(23)14-11(3)20-12(4)15(18(24)22-6-2)16(14)13-8-7-9-19-10-13/h7-10,16,20H,5-6H2,1-4H3