ethyl 4-[4-[6-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]phenoxy]butanoate

Systemtic Name: ethyl 4-[4-[6-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]phenoxy]butanoate Openeye Name: ethyl 4-[4-[6-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]phenoxy]butanoate CAS Name: 4-[4-[6-[6-(4-methyl-1-piperazinyl)-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]phenoxy]butanoic acid ethyl ester IUPAC Name: ethyl 4-[4-[6-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]phenoxy]butanoate Traditional Name: 4-[4-[6-[6-(4-methylpiperazino)-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]phenoxy]butyric acid ethyl ester Formula: C31H34N6O3 MolecularWeight: 538.64006

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)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

CCOC(=O)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/C31H34N6O3/c1-3-39-29(38)5-4-18-40-24-10-6-21(7-11-24)30-32-25-12-8-22(19-27(25)34-30)31-33-26-13-9-23(20-28(26)35-31)37-16-14-36(2)15-17-37/h6-13,19-20H,3-5,14-18H2,1-2H3,(H,32,34)(H,33,35)