dibutyl 2,6-dimethyl-4-(3-methyl-2-methylsulfanyl-imidazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: dibutyl 2,6-dimethyl-4-(3-methyl-2-methylsulfanyl-imidazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: dibutyl 2,6-dimethyl-4-(3-methyl-2-methylsulfanyl-imidazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-[3-methyl-2-(methylthio)-4-imidazolyl]-1,4-dihydropyridine-3,5-dicarboxylic acid dibutyl ester IUPAC Name: dibutyl 2,6-dimethyl-4-(3-methyl-2-methylsulfanylimidazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-[3-methyl-2-(methylthio)imidazol-4-yl]-1,4-dihydropyridine-3,5-dicarboxylic acid dibutyl ester Formula: C22H33N3O4S MolecularWeight: 435.58012

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(NC(=C(C1C2=CN=C(N2C)SC)C(=O)OCCCC)C)C

Isomeric SMILES

CCCCOC(=O)C1=C(NC(=C(C1C2=CN=C(N2C)SC)C(=O)OCCCC)C)C

InChI

InChI=1S/C22H33N3O4S/c1-7-9-11-28-20(26)17-14(3)24-15(4)18(21(27)29-12-10-8-2)19(17)16-13-23-22(30-6)25(16)5/h13,19,24H,7-12H2,1-6H3