dipropan-2-yl 4-(2-methoxy-6-pentadecyl-phenyl)-1,2-dimethyl-6-(2-sulfanyl-2,3-dihydrobenzimidazol-1-yl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: dipropan-2-yl 4-(2-methoxy-6-pentadecyl-phenyl)-1,2-dimethyl-6-(2-sulfanyl-2,3-dihydrobenzimidazol-1-yl)-4H-pyridine-3,5-dicarboxylate Openeye Name: diisopropyl 4-(2-methoxy-6-pentadecyl-phenyl)-1,2-dimethyl-6-(2-sulfanyl-2,3-dihydrobenzimidazol-1-yl)-4H-pyridine-3,5-dicarboxylate CAS Name: 2-(2-mercapto-2,3-dihydrobenzimidazol-1-yl)-4-(2-methoxy-6-pentadecylphenyl)-1,6-dimethyl-4H-pyridine-3,5-dicarboxylic acid dipropan-2-yl ester IUPAC Name: dipropan-2-yl 4-(2-methoxy-6-pentadecylphenyl)-1,2-dimethyl-6-(2-sulfanyl-2,3-dihydrobenzimidazol-1-yl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 2-(2-mercapto-2,3-dihydrobenzimidazol-1-yl)-4-(2-methoxy-6-pentadecyl-phenyl)-1,6-dimethyl-4H-pyridine-3,5-dicarboxylic acid diisopropyl ester Formula: C44H65N3O5S MolecularWeight: 748.069

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=C(C(=CC=C1)OC)C2C(=C(N(C(=C2C(=O)OC(C)C)N3C(NC4=CC=CC=C43)S)C)C)C(=O)OC(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCC1=C(C(=CC=C1)OC)C2C(=C(N(C(=C2C(=O)OC(C)C)N3C(NC4=CC=CC=C43)S)C)C)C(=O)OC(C)C

InChI

InChI=1S/C44H65N3O5S/c1-9-10-11-12-13-14-15-16-17-18-19-20-21-25-33-26-24-29-36(50-8)38(33)39-37(42(48)51-30(2)3)32(6)46(7)41(40(39)43(49)52-31(4)5)47-35-28-23-22-27-34(35)45-44(47)53/h22-24,26-31,39,44-45,53H,9-21,25H2,1-8H3