N-(1-adamantyl)-2-[2-(phenylmethyl)sulfonylbenzimidazol-1-yl]ethanamide

Systemtic Name: N-(1-adamantyl)-2-[2-(phenylmethyl)sulfonylbenzimidazol-1-yl]ethanamide Openeye Name: N-(1-adamantyl)-2-(2-benzylsulfonylbenzimidazol-1-yl)acetamide CAS Name: N-(1-adamantyl)-2-[2-(phenylmethyl)sulfonyl-1-benzimidazolyl]acetamide IUPAC Name: N-(1-adamantyl)-2-(2-benzylsulfonylbenzimidazol-1-yl)acetamide Traditional Name: N-(1-adamantyl)-2-(2-benzylsulfonylbenzimidazol-1-yl)acetamide Formula: C26H29N3O3S MolecularWeight: 463.59176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)CN4C5=CC=CC=C5N=C4S(=O)(=O)CC6=CC=CC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)CN4C5=CC=CC=C5N=C4S(=O)(=O)CC6=CC=CC=C6

InChI

InChI=1S/C26H29N3O3S/c30-24(28-26-13-19-10-20(14-26)12-21(11-19)15-26)16-29-23-9-5-4-8-22(23)27-25(29)33(31,32)17-18-6-2-1-3-7-18/h1-9,19-21H,10-17H2,(H,28,30)