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

Systemtic Name: 2-[4-[[2-ethyl-6-(phenylsulfonylmethylamino)benzimidazol-1-yl]methyl]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[[6-(benzenesulfonylmethylamino)-2-ethyl-benzimidazol-1-yl]methyl]phenyl]benzonitrile CAS Name: 2-[4-[[6-(benzenesulfonylmethylamino)-2-ethyl-1-benzimidazolyl]methyl]phenyl]benzonitrile IUPAC Name: 2-[4-[[6-(benzenesulfonylmethylamino)-2-ethylbenzimidazol-1-yl]methyl]phenyl]benzonitrile Traditional Name: 2-[4-[[6-(besylmethylamino)-2-ethyl-benzimidazol-1-yl]methyl]phenyl]benzonitrile Formula: C30H26N4O2S MolecularWeight: 506.61804

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C#N)C=C(C=C2)NCS(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C#N)C=C(C=C2)NCS(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C30H26N4O2S/c1-2-30-33-28-17-16-25(32-21-37(35,36)26-9-4-3-5-10-26)18-29(28)34(30)20-22-12-14-23(15-13-22)27-11-7-6-8-24(27)19-31/h3-18,32H,2,20-21H2,1H3