tert-butyl 4-[3-[5-(furan-3-yl)benzimidazol-1-yl]phenyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-[5-(furan-3-yl)benzimidazol-1-yl]phenyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-[5-(3-furyl)benzimidazol-1-yl]phenyl]piperazine-1-carboxylate CAS Name: 4-[3-[5-(3-furanyl)-1-benzimidazolyl]phenyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-[5-(furan-3-yl)benzimidazol-1-yl]phenyl]piperazine-1-carboxylate Traditional Name: 4-[3-[5-(3-furyl)benzimidazol-1-yl]phenyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C26H28N4O3 MolecularWeight: 444.52552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=CC(=C2)N3C=NC4=C3C=CC(=C4)C5=COC=C5

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=CC(=C2)N3C=NC4=C3C=CC(=C4)C5=COC=C5

InChI

InChI=1S/C26H28N4O3/c1-26(2,3)33-25(31)29-12-10-28(11-13-29)21-5-4-6-22(16-21)30-18-27-23-15-19(7-8-24(23)30)20-9-14-32-17-20/h4-9,14-18H,10-13H2,1-3H3