tert-butyl [3-[4-chloranyl-6-(1-methylbenzimidazol-2-yl)-2-propyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] carbonate

Systemtic Name: tert-butyl [3-[4-chloranyl-6-(1-methylbenzimidazol-2-yl)-2-propyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] carbonate Openeye Name: tert-butyl [3-[4-chloro-6-(1-methylbenzimidazol-2-yl)-2-propyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] carbonate CAS Name: carbonic acid tert-butyl [3-[4-chloro-6-(1-methyl-2-benzimidazolyl)-2-propyl-1-benzimidazolyl]-2-methyl-6-phenylphenyl] ester IUPAC Name: tert-butyl [3-[4-chloro-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazol-1-yl]-2-methyl-6-phenylphenyl] carbonate Traditional Name: carbonic acid tert-butyl [3-[4-chloro-6-(1-methylbenzimidazol-2-yl)-2-propyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] ester Formula: C36H35ClN4O3 MolecularWeight: 607.1411

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)OC(C)(C)C)C)C=C(C=C2Cl)C5=NC6=CC=CC=C6N5C

Isomeric SMILES

CCCC1=NC2=C(N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)OC(C)(C)C)C)C=C(C=C2Cl)C5=NC6=CC=CC=C6N5C

InChI

InChI=1S/C36H35ClN4O3/c1-7-13-31-39-32-26(37)20-24(34-38-27-16-11-12-17-29(27)40(34)6)21-30(32)41(31)28-19-18-25(23-14-9-8-10-15-23)33(22(28)2)43-35(42)44-36(3,4)5/h8-12,14-21H,7,13H2,1-6H3