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

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

Systemtic Name:tert-butyl [3-[6-(1-cycloheptylimidazol-4-yl)-4-methyl-2-propyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] carbonate
Openeye Name:tert-butyl [3-[6-(1-cycloheptylimidazol-4-yl)-4-methyl-2-propyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] carbonate
CAS Name:carbonic acid tert-butyl [3-[6-(1-cycloheptyl-4-imidazolyl)-4-methyl-2-propyl-1-benzimidazolyl]-2-methyl-6-phenylphenyl] ester
IUPAC Name:tert-butyl [3-[6-(1-cycloheptylimidazol-4-yl)-4-methyl-2-propylbenzimidazol-1-yl]-2-methyl-6-phenylphenyl] carbonate
Traditional Name:carbonic acid tert-butyl [3-[6-(1-cycloheptylimidazol-4-yl)-4-methyl-2-propyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] ester
Formula: C39H46N4O3
MolecularWeight: 618.80754
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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=C(C=C2N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)OC(C)(C)C)C)C5=CN(C=N5)C6CCCCCC6)C


Isomeric SMILES

CCCC1=NC2=C(C=C(C=C2N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)OC(C)(C)C)C)C5=CN(C=N5)C6CCCCCC6)C


InChI

InChI=1S/C39H46N4O3/c1-7-15-35-41-36-26(2)22-29(32-24-42(25-40-32)30-18-13-8-9-14-19-30)23-34(36)43(35)33-21-20-31(28-16-11-10-12-17-28)37(27(33)3)45-38(44)46-39(4,5)6/h10-12,16-17,20-25,30H,7-9,13-15,18-19H2,1-6H3


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