2-[2-[(3R)-3-(4-fluoranylpiperidin-1-yl)pyrrolidin-1-yl]-1,3-benzothiazol-6-yl]pyridazin-3-one

Systemtic Name: 2-[2-[(3R)-3-(4-fluoranylpiperidin-1-yl)pyrrolidin-1-yl]-1,3-benzothiazol-6-yl]pyridazin-3-one Openeye Name: 2-[2-[(3R)-3-(4-fluoranyl-1-piperidyl)pyrrolidin-1-yl]-1,3-benzothiazol-6-yl]pyridazin-3-one CAS Name: 2-[2-[(3R)-3-(4-fluoranyl-1-piperidinyl)-1-pyrrolidinyl]-1,3-benzothiazol-6-yl]-3-pyridazinone IUPAC Name: 2-[2-[(3R)-3-(4-fluoranylpiperidin-1-yl)pyrrolidin-1-yl]-1,3-benzothiazol-6-yl]pyridazin-3-one Traditional Name: 2-[2-[(3R)-3-(4-fluoranylpiperidino)pyrrolidino]-1,3-benzothiazol-6-yl]pyridazin-3-one Formula: C20H22FN5OS MolecularWeight: 398.487518

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1F)C2CCN(C2)C3=NC4=C(S3)C=C(C=C4)N5C(=O)C=CC=N5

Isomeric SMILES

C1CN(C[C@@H]1N2CCC(CC2)[18F])C3=NC4=C(S3)C=C(C=C4)N5C(=O)C=CC=N5

InChI

InChI=1S/C20H22FN5OS/c21-14-5-9-24(10-6-14)16-7-11-25(13-16)20-23-17-4-3-15(12-18(17)28-20)26-19(27)2-1-8-22-26/h1-4,8,12,14,16H,5-7,9-11,13H2/t16-/m1/s1/i21-1