2-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-4-fluoranyl-benzamide

Systemtic Name: 2-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-4-fluoranyl-benzamide Openeye Name: 2-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-4-fluoro-benzamide CAS Name: 2-[2-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]ethyl]-4-fluorobenzamide IUPAC Name: 2-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-4-fluorobenzamide Traditional Name: 2-[2-[4-(1,2-benzothiazol-3-yl)piperazino]ethyl]-4-fluoro-benzamide Formula: C20H21FN4OS MolecularWeight: 384.470343

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=C(C=CC(=C2)F)C(=O)N)C3=NSC4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1CCC2=C(C=CC(=C2)F)C(=O)N)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C20H21FN4OS/c21-15-5-6-16(19(22)26)14(13-15)7-8-24-9-11-25(12-10-24)20-17-3-1-2-4-18(17)27-23-20/h1-6,13H,7-12H2,(H2,22,26)