N-[2-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]-3-fluoranyl-benzamide

Systemtic Name: N-[2-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]-3-fluoranyl-benzamide Openeye Name: N-[2-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]-2-oxo-ethyl]-3-fluoro-benzamide CAS Name: N-[2-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-2-oxoethyl]-3-fluorobenzamide IUPAC Name: N-[2-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxoethyl]-3-fluorobenzamide Traditional Name: N-[2-[4-(1,3-benzothiazol-2-yl)piperidino]-2-keto-ethyl]-3-fluoro-benzamide Formula: C21H20FN3O2S MolecularWeight: 397.465803

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)CNC(=O)C4=CC(=CC=C4)F

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)CNC(=O)C4=CC(=CC=C4)F

InChI

InChI=1S/C21H20FN3O2S/c22-16-5-3-4-15(12-16)20(27)23-13-19(26)25-10-8-14(9-11-25)21-24-17-6-1-2-7-18(17)28-21/h1-7,12,14H,8-11,13H2,(H,23,27)