N-[4-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methylsulfanyl]phenyl]ethanamide

Systemtic Name: N-[4-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methylsulfanyl]phenyl]ethanamide Openeye Name: N-[4-[[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]methylsulfanyl]phenyl]acetamide CAS Name: N-[4-[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]methylthio]phenyl]acetamide IUPAC Name: N-[4-[(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)methylsulfanyl]phenyl]acetamide Traditional Name: N-[4-[(1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)methylthio]phenyl]acetamide Formula: C23H28N4O3S2 MolecularWeight: 472.62342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CSC4=CC=C(C=C4)NC(=O)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CSC4=CC=C(C=C4)NC(=O)C

InChI

InChI=1S/C23H28N4O3S2/c1-3-27-22-12-11-20(32(29,30)26-13-5-4-6-14-26)15-21(22)25-23(27)16-31-19-9-7-18(8-10-19)24-17(2)28/h7-12,15H,3-6,13-14,16H2,1-2H3,(H,24,28)