2-[4-methoxy-3-(2-phenylpropoxy)phenyl]-6-(1,2,4-triazol-1-yl)-1H-benzimidazole

Systemtic Name: 2-[4-methoxy-3-(2-phenylpropoxy)phenyl]-6-(1,2,4-triazol-1-yl)-1H-benzimidazole Openeye Name: 2-[4-methoxy-3-(2-phenylpropoxy)phenyl]-6-(1,2,4-triazol-1-yl)-1H-benzimidazole CAS Name: 2-[4-methoxy-3-(2-phenylpropoxy)phenyl]-6-(1,2,4-triazol-1-yl)-1H-benzimidazole IUPAC Name: 2-[4-methoxy-3-(2-phenylpropoxy)phenyl]-6-(1,2,4-triazol-1-yl)-1H-benzimidazole Traditional Name: 2-[4-methoxy-3-(2-phenylpropoxy)phenyl]-6-(1,2,4-triazol-1-yl)-1H-benzimidazole Formula: C25H23N5O2 MolecularWeight: 425.48242

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=C(C=CC(=C1)C2=NC3=C(N2)C=C(C=C3)N4C=NC=N4)OC)C5=CC=CC=C5

Isomeric SMILES

CC(COC1=C(C=CC(=C1)C2=NC3=C(N2)C=C(C=C3)N4C=NC=N4)OC)C5=CC=CC=C5

InChI

InChI=1S/C25H23N5O2/c1-17(18-6-4-3-5-7-18)14-32-24-12-19(8-11-23(24)31-2)25-28-21-10-9-20(13-22(21)29-25)30-16-26-15-27-30/h3-13,15-17H,14H2,1-2H3,(H,28,29)