1-[4-(4-fluoranyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-(phenylmethylsulfanyl)ethanone

Systemtic Name: 1-[4-(4-fluoranyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-(phenylmethylsulfanyl)ethanone Openeye Name: 2-benzylsulfanyl-1-[4-(4-fluoro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone CAS Name: 1-[4-(4-fluoro-1,3-benzothiazol-2-yl)-1-piperazinyl]-2-(phenylmethylthio)ethanone IUPAC Name: 2-benzylsulfanyl-1-[4-(4-fluoro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone Traditional Name: 2-(benzylthio)-1-[4-(4-fluoro-1,3-benzothiazol-2-yl)piperazino]ethanone Formula: C20H20FN3OS2 MolecularWeight: 401.520703

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=C(C=CC=C3S2)F)C(=O)CSCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=NC3=C(C=CC=C3S2)F)C(=O)CSCC4=CC=CC=C4

InChI

InChI=1S/C20H20FN3OS2/c21-16-7-4-8-17-19(16)22-20(27-17)24-11-9-23(10-12-24)18(25)14-26-13-15-5-2-1-3-6-15/h1-8H,9-14H2