2-methyl-6-phenyl-3-[6-(phenylsulfonylmethylamino)-2-propyl-benzimidazol-1-yl]benzenecarbonitrile

Systemtic Name: 2-methyl-6-phenyl-3-[6-(phenylsulfonylmethylamino)-2-propyl-benzimidazol-1-yl]benzenecarbonitrile Openeye Name: 3-[6-(benzenesulfonylmethylamino)-2-propyl-benzimidazol-1-yl]-2-methyl-6-phenyl-benzonitrile CAS Name: 3-[6-(benzenesulfonylmethylamino)-2-propyl-1-benzimidazolyl]-2-methyl-6-phenylbenzonitrile IUPAC Name: 3-[6-(benzenesulfonylmethylamino)-2-propylbenzimidazol-1-yl]-2-methyl-6-phenylbenzonitrile Traditional Name: 3-[6-(besylmethylamino)-2-propyl-benzimidazol-1-yl]-2-methyl-6-phenyl-benzonitrile Formula: C31H28N4O2S MolecularWeight: 520.64462

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(N1C3=C(C(=C(C=C3)C4=CC=CC=C4)C#N)C)C=C(C=C2)NCS(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CCCC1=NC2=C(N1C3=C(C(=C(C=C3)C4=CC=CC=C4)C#N)C)C=C(C=C2)NCS(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C31H28N4O2S/c1-3-10-31-34-28-17-15-24(33-21-38(36,37)25-13-8-5-9-14-25)19-30(28)35(31)29-18-16-26(27(20-32)22(29)2)23-11-6-4-7-12-23/h4-9,11-19,33H,3,10,21H2,1-2H3