dimethyl 2-methyl-6-[(6-methyl-1H-benzimidazol-2-yl)sulfanylmethyl]-4-(2-pentadecyl-6-propan-2-yloxy-phenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 2-methyl-6-[(6-methyl-1H-benzimidazol-2-yl)sulfanylmethyl]-4-(2-pentadecyl-6-propan-2-yloxy-phenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: dimethyl 4-(2-isopropoxy-6-pentadecyl-phenyl)-2-methyl-6-[(6-methyl-1H-benzimidazol-2-yl)sulfanylmethyl]-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-methyl-6-[[(6-methyl-1H-benzimidazol-2-yl)thio]methyl]-4-(2-pentadecyl-6-propan-2-yloxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-methyl-6-[(6-methyl-1H-benzimidazol-2-yl)sulfanylmethyl]-4-(2-pentadecyl-6-propan-2-yloxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(2-isopropoxy-6-pentadecyl-phenyl)-2-methyl-6-[[(6-methyl-1H-benzimidazol-2-yl)thio]methyl]-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester Formula: C43H61N3O5S MolecularWeight: 732.02654

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=C(C(=CC=C1)OC(C)C)C2C(=C(NC(=C2C(=O)OC)CSC3=NC4=C(N3)C=C(C=C4)C)C)C(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCC1=C(C(=CC=C1)OC(C)C)C2C(=C(NC(=C2C(=O)OC)CSC3=NC4=C(N3)C=C(C=C4)C)C)C(=O)OC

InChI

InChI=1S/C43H61N3O5S/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-22-32-23-21-24-36(51-29(2)3)38(32)40-37(41(47)49-6)31(5)44-35(39(40)42(48)50-7)28-52-43-45-33-26-25-30(4)27-34(33)46-43/h21,23-27,29,40,44H,8-20,22,28H2,1-7H3,(H,45,46)