1-[(2R)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-3-(1,3-benzothiazol-2-yl)propan-1-one

Systemtic Name: 1-[(2R)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-3-(1,3-benzothiazol-2-yl)propan-1-one Openeye Name: 1-[(2R)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-3-(1,3-benzothiazol-2-yl)propan-1-one CAS Name: 1-[(2R)-2-(1H-benzimidazol-2-yl)-1-pyrrolidinyl]-3-(1,3-benzothiazol-2-yl)-1-propanone IUPAC Name: 1-[(2R)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-3-(1,3-benzothiazol-2-yl)propan-1-one Traditional Name: 1-[(2R)-2-(1H-benzimidazol-2-yl)pyrrolidino]-3-(1,3-benzothiazol-2-yl)propan-1-one Formula: C21H20N4OS MolecularWeight: 376.4747

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCC2=NC3=CC=CC=C3S2)C4=NC5=CC=CC=C5N4

Isomeric SMILES

C1C[C@@H](N(C1)C(=O)CCC2=NC3=CC=CC=C3S2)C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C21H20N4OS/c26-20(12-11-19-22-16-8-3-4-10-18(16)27-19)25-13-5-9-17(25)21-23-14-6-1-2-7-15(14)24-21/h1-4,6-8,10,17H,5,9,11-13H2,(H,23,24)/t17-/m1/s1