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

Systemtic Name: 6-(4-methylpiperazin-1-yl)-2-[2-(4-phenoxyphenyl)-3H-benzimidazol-5-yl]-1H-benzimidazole Openeye Name: 6-(4-methylpiperazin-1-yl)-2-[2-(4-phenoxyphenyl)-3H-benzimidazol-5-yl]-1H-benzimidazole CAS Name: 6-(4-methyl-1-piperazinyl)-2-[2-(4-phenoxyphenyl)-3H-benzimidazol-5-yl]-1H-benzimidazole IUPAC Name: 6-(4-methylpiperazin-1-yl)-2-[2-(4-phenoxyphenyl)-3H-benzimidazol-5-yl]-1H-benzimidazole Traditional Name: 6-(4-methylpiperazino)-2-[2-(4-phenoxyphenyl)-3H-benzimidazol-5-yl]-1H-benzimidazole Formula: C31H28N6O MolecularWeight: 500.59362

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC3=C(C=C2)N=C(N3)C4=CC5=C(C=C4)N=C(N5)C6=CC=C(C=C6)OC7=CC=CC=C7

Isomeric SMILES

CN1CCN(CC1)C2=CC3=C(C=C2)N=C(N3)C4=CC5=C(C=C4)N=C(N5)C6=CC=C(C=C6)OC7=CC=CC=C7

InChI

InChI=1S/C31H28N6O/c1-36-15-17-37(18-16-36)23-10-14-27-29(20-23)35-31(33-27)22-9-13-26-28(19-22)34-30(32-26)21-7-11-25(12-8-21)38-24-5-3-2-4-6-24/h2-14,19-20H,15-18H2,1H3,(H,32,34)(H,33,35)