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

Systemtic Name: tert-butyl [3-[2-butyl-6-(phenylsulfonylmethylamino)benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] carbonate Openeye Name: [3-[6-(benzenesulfonylmethylamino)-2-butyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] tert-butyl carbonate CAS Name: carbonic acid [3-[6-(benzenesulfonylmethylamino)-2-butyl-1-benzimidazolyl]-2-methyl-6-phenylphenyl] tert-butyl ester IUPAC Name: [3-[6-(benzenesulfonylmethylamino)-2-butylbenzimidazol-1-yl]-2-methyl-6-phenylphenyl] tert-butyl carbonate Traditional Name: carbonic acid [3-[6-(besylmethylamino)-2-butyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] tert-butyl ester Formula: C36H39N3O5S MolecularWeight: 625.77696

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)OC(C)(C)C)C)C=C(C=C2)NCS(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CCCCC1=NC2=C(N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)OC(C)(C)C)C)C=C(C=C2)NCS(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C36H39N3O5S/c1-6-7-18-33-38-30-21-19-27(37-24-45(41,42)28-16-12-9-13-17-28)23-32(30)39(33)31-22-20-29(26-14-10-8-11-15-26)34(25(31)2)43-35(40)44-36(3,4)5/h8-17,19-23,37H,6-7,18,24H2,1-5H3