[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-(2-cyclopropylquinolin-4-yl)methanone

Systemtic Name: [(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-(2-cyclopropylquinolin-4-yl)methanone Openeye Name: [(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-(2-cyclopropyl-4-quinolyl)methanone CAS Name: [(2S)-2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-(2-cyclopropyl-4-quinolinyl)methanone IUPAC Name: [(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-(2-cyclopropylquinolin-4-yl)methanone Traditional Name: [(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidino]-(2-cyclopropyl-4-quinolyl)methanone Formula: C24H21N3OS MolecularWeight: 399.50804

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC(=NC3=CC=CC=C32)C4CC4)C5=NC6=CC=CC=C6S5

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C2=CC(=NC3=CC=CC=C32)C4CC4)C5=NC6=CC=CC=C6S5

InChI

InChI=1S/C24H21N3OS/c28-24(17-14-20(15-11-12-15)25-18-7-2-1-6-16(17)18)27-13-5-9-21(27)23-26-19-8-3-4-10-22(19)29-23/h1-4,6-8,10,14-15,21H,5,9,11-13H2/t21-/m0/s1