tert-butyl [2-[(2-butylsulfanylbenzimidazol-1-yl)methyl]-6-phenyl-phenyl] carbonate

Systemtic Name: tert-butyl [2-[(2-butylsulfanylbenzimidazol-1-yl)methyl]-6-phenyl-phenyl] carbonate Openeye Name: tert-butyl [2-[(2-butylsulfanylbenzimidazol-1-yl)methyl]-6-phenyl-phenyl] carbonate CAS Name: carbonic acid tert-butyl [2-[[2-(butylthio)-1-benzimidazolyl]methyl]-6-phenylphenyl] ester IUPAC Name: tert-butyl [2-[(2-butylsulfanylbenzimidazol-1-yl)methyl]-6-phenylphenyl] carbonate Traditional Name: carbonic acid tert-butyl [2-[[2-(butylthio)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] ester Formula: C29H32N2O3S MolecularWeight: 488.64098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC2=CC=CC=C2N1CC3=CC=CC(=C3OC(=O)OC(C)(C)C)C4=CC=CC=C4

Isomeric SMILES

CCCCSC1=NC2=CC=CC=C2N1CC3=CC=CC(=C3OC(=O)OC(C)(C)C)C4=CC=CC=C4

InChI

InChI=1S/C29H32N2O3S/c1-5-6-19-35-27-30-24-17-10-11-18-25(24)31(27)20-22-15-12-16-23(21-13-8-7-9-14-21)26(22)33-28(32)34-29(2,3)4/h7-18H,5-6,19-20H2,1-4H3