6-(4-methylpiperazin-1-yl)-2-[2-(4-propoxyphenyl)-3H-benzimidazol-5-yl]-1H-benzimidazole

Systemtic Name: 6-(4-methylpiperazin-1-yl)-2-[2-(4-propoxyphenyl)-3H-benzimidazol-5-yl]-1H-benzimidazole Openeye Name: 6-(4-methylpiperazin-1-yl)-2-[2-(4-propoxyphenyl)-3H-benzimidazol-5-yl]-1H-benzimidazole CAS Name: 6-(4-methyl-1-piperazinyl)-2-[2-(4-propoxyphenyl)-3H-benzimidazol-5-yl]-1H-benzimidazole IUPAC Name: 6-(4-methylpiperazin-1-yl)-2-[2-(4-propoxyphenyl)-3H-benzimidazol-5-yl]-1H-benzimidazole Traditional Name: 6-(4-methylpiperazino)-2-[2-(4-propoxyphenyl)-3H-benzimidazol-5-yl]-1H-benzimidazole Formula: C28H30N6O MolecularWeight: 466.5774

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)C4=NC5=C(N4)C=C(C=C5)N6CCN(CC6)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)C4=NC5=C(N4)C=C(C=C5)N6CCN(CC6)C

InChI

InChI=1S/C28H30N6O/c1-3-16-35-22-8-4-19(5-9-22)27-29-23-10-6-20(17-25(23)31-27)28-30-24-11-7-21(18-26(24)32-28)34-14-12-33(2)13-15-34/h4-11,17-18H,3,12-16H2,1-2H3,(H,29,31)(H,30,32)