butanedioic acid; 1-methyl-2-[[4-(1-methyl-4-pyridin-4-yl-pyrazol-3-yl)phenoxy]methyl]benzimidazole

Systemtic Name: butanedioic acid; 1-methyl-2-[[4-(1-methyl-4-pyridin-4-yl-pyrazol-3-yl)phenoxy]methyl]benzimidazole Openeye Name: 1-methyl-2-[[4-[1-methyl-4-(4-pyridyl)pyrazol-3-yl]phenoxy]methyl]benzimidazole; succinic acid CAS Name: butanedioic acid; 1-methyl-2-[[4-(1-methyl-4-pyridin-4-yl-3-pyrazolyl)phenoxy]methyl]benzimidazole IUPAC Name: butanedioic acid; 1-methyl-2-[[4-(1-methyl-4-pyridin-4-ylpyrazol-3-yl)phenoxy]methyl]benzimidazole Traditional Name: 1-methyl-2-[[4-[1-methyl-4-(4-pyridyl)pyrazol-3-yl]phenoxy]methyl]benzimidazole; succinic acid Formula: C28H27N5O5 MolecularWeight: 513.54448

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC=C(C=C2)OCC3=NC4=CC=CC=C4N3C)C5=CC=NC=C5.C(CC(=O)O)C(=O)O

Isomeric SMILES

CN1C=C(C(=N1)C2=CC=C(C=C2)OCC3=NC4=CC=CC=C4N3C)C5=CC=NC=C5.C(CC(=O)O)C(=O)O

InChI

InChI=1S/C24H21N5O.C4H6O4/c1-28-15-20(17-11-13-25-14-12-17)24(27-28)18-7-9-19(10-8-18)30-16-23-26-21-5-3-4-6-22(21)29(23)2;5-3(6)1-2-4(7)8/h3-15H,16H2,1-2H3;1-2H2,(H,5,6)(H,7,8)