2-(1H-benzimidazol-2-ylmethylsulfanyl)-1-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]ethanone

Systemtic Name: 2-(1H-benzimidazol-2-ylmethylsulfanyl)-1-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]ethanone Openeye Name: 2-(1H-benzimidazol-2-ylmethylsulfanyl)-1-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]ethanone CAS Name: 2-(1H-benzimidazol-2-ylmethylthio)-1-[(2S)-2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]ethanone IUPAC Name: 2-(1H-benzimidazol-2-ylmethylsulfanyl)-1-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]ethanone Traditional Name: 2-(1H-benzimidazol-2-ylmethylthio)-1-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidino]ethanone Formula: C21H20N4OS2 MolecularWeight: 408.5397

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CSCC2=NC3=CC=CC=C3N2)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C[C@H](N(C1)C(=O)CSCC2=NC3=CC=CC=C3N2)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C21H20N4OS2/c26-20(13-27-12-19-22-14-6-1-2-7-15(14)23-19)25-11-5-9-17(25)21-24-16-8-3-4-10-18(16)28-21/h1-4,6-8,10,17H,5,9,11-13H2,(H,22,23)/t17-/m0/s1