tert-butyl [3-[6-[1-(2-diethylaminoethyl)imidazol-4-yl]-2-ethyl-4-methyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] carbonate

Systemtic Name: tert-butyl [3-[6-[1-(2-diethylaminoethyl)imidazol-4-yl]-2-ethyl-4-methyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] carbonate Openeye Name: tert-butyl [3-[6-[1-(2-diethylaminoethyl)imidazol-4-yl]-2-ethyl-4-methyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] carbonate CAS Name: carbonic acid tert-butyl [3-[6-[1-(2-diethylaminoethyl)-4-imidazolyl]-2-ethyl-4-methyl-1-benzimidazolyl]-2-methyl-6-phenylphenyl] ester IUPAC Name: tert-butyl [3-[6-[1-(2-diethylaminoethyl)imidazol-4-yl]-2-ethyl-4-methylbenzimidazol-1-yl]-2-methyl-6-phenylphenyl] carbonate Traditional Name: carbonic acid tert-butyl [3-[6-[1-(2-diethylaminoethyl)imidazol-4-yl]-2-ethyl-4-methyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] ester Formula: C37H45N5O3 MolecularWeight: 607.7849

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=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)CCN(CC)CC)C

Isomeric SMILES

CCC1=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)CCN(CC)CC)C

InChI

InChI=1S/C37H45N5O3/c1-9-33-39-34-25(4)21-28(30-23-41(24-38-30)20-19-40(10-2)11-3)22-32(34)42(33)31-18-17-29(27-15-13-12-14-16-27)35(26(31)5)44-36(43)45-37(6,7)8/h12-18,21-24H,9-11,19-20H2,1-8H3