ethyl 2-(4-ethanoylpiperazin-1-yl)-3-[5-(furan-3-yl)benzimidazol-1-yl]benzoate

Systemtic Name: ethyl 2-(4-ethanoylpiperazin-1-yl)-3-[5-(furan-3-yl)benzimidazol-1-yl]benzoate Openeye Name: ethyl 2-(4-acetylpiperazin-1-yl)-3-[5-(3-furyl)benzimidazol-1-yl]benzoate CAS Name: 2-(4-acetyl-1-piperazinyl)-3-[5-(3-furanyl)-1-benzimidazolyl]benzoic acid ethyl ester IUPAC Name: ethyl 2-(4-acetylpiperazin-1-yl)-3-[5-(furan-3-yl)benzimidazol-1-yl]benzoate Traditional Name: 2-(4-acetylpiperazino)-3-[5-(3-furyl)benzimidazol-1-yl]benzoic acid ethyl ester Formula: C26H26N4O4 MolecularWeight: 458.50904

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CC=C1)N2C=NC3=C2C=CC(=C3)C4=COC=C4)N5CCN(CC5)C(=O)C

Isomeric SMILES

CCOC(=O)C1=C(C(=CC=C1)N2C=NC3=C2C=CC(=C3)C4=COC=C4)N5CCN(CC5)C(=O)C

InChI

InChI=1S/C26H26N4O4/c1-3-34-26(32)21-5-4-6-24(25(21)29-12-10-28(11-13-29)18(2)31)30-17-27-22-15-19(7-8-23(22)30)20-9-14-33-16-20/h4-9,14-17H,3,10-13H2,1-2H3