2-[4-[[2-butyl-4-methyl-6-(phenylsulfonylmethylamino)benzimidazol-1-yl]methyl]phenyl]benzenecarbonitrile

Systemtic Name: 2-[4-[[2-butyl-4-methyl-6-(phenylsulfonylmethylamino)benzimidazol-1-yl]methyl]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[[6-(benzenesulfonylmethylamino)-2-butyl-4-methyl-benzimidazol-1-yl]methyl]phenyl]benzonitrile CAS Name: 2-[4-[[6-(benzenesulfonylmethylamino)-2-butyl-4-methyl-1-benzimidazolyl]methyl]phenyl]benzonitrile IUPAC Name: 2-[4-[[6-(benzenesulfonylmethylamino)-2-butyl-4-methylbenzimidazol-1-yl]methyl]phenyl]benzonitrile Traditional Name: 2-[4-[[6-(besylmethylamino)-2-butyl-4-methyl-benzimidazol-1-yl]methyl]phenyl]benzonitrile Formula: C33H32N4O2S MolecularWeight: 548.69778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C#N)C=C(C=C2C)NCS(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C#N)C=C(C=C2C)NCS(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C33H32N4O2S/c1-3-4-14-32-36-33-24(2)19-28(35-23-40(38,39)29-11-6-5-7-12-29)20-31(33)37(32)22-25-15-17-26(18-16-25)30-13-9-8-10-27(30)21-34/h5-13,15-20,35H,3-4,14,22-23H2,1-2H3