2-(1-naphthalen-2-ylsulfonylbenzimidazol-2-yl)sulfanyl-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-(1-naphthalen-2-ylsulfonylbenzimidazol-2-yl)sulfanyl-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[1-(2-naphthylsulfonyl)benzimidazol-2-yl]sulfanyl-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[[1-(2-naphthalenylsulfonyl)-2-benzimidazolyl]thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-(1-naphthalen-2-ylsulfonylbenzimidazol-2-yl)sulfanyl-1-pyrrolidin-1-ylethanone Traditional Name: 2-[[1-(2-naphthylsulfonyl)benzimidazol-2-yl]thio]-1-pyrrolidino-ethanone Formula: C23H21N3O3S2 MolecularWeight: 451.56114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CSC2=NC3=CC=CC=C3N2S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CCN(C1)C(=O)CSC2=NC3=CC=CC=C3N2S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C23H21N3O3S2/c27-22(25-13-5-6-14-25)16-30-23-24-20-9-3-4-10-21(20)26(23)31(28,29)19-12-11-17-7-1-2-8-18(17)15-19/h1-4,7-12,15H,5-6,13-14,16H2