5-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-4-chloranyl-2-phenyl-pyridazin-3-one

Systemtic Name: 5-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-4-chloranyl-2-phenyl-pyridazin-3-one Openeye Name: 5-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-4-chloro-2-phenyl-pyridazin-3-one CAS Name: 5-[(2R)-2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-4-chloro-2-phenyl-3-pyridazinone IUPAC Name: 5-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-4-chloro-2-phenylpyridazin-3-one Traditional Name: 5-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidino]-4-chloro-2-phenyl-pyridazin-3-one Formula: C21H17ClN4OS MolecularWeight: 408.90388

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C[C@@H](N(C1)C2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C21H17ClN4OS/c22-19-17(13-23-26(21(19)27)14-7-2-1-3-8-14)25-12-6-10-16(25)20-24-15-9-4-5-11-18(15)28-20/h1-5,7-9,11,13,16H,6,10,12H2/t16-/m1/s1