1-[4-(6-fluoranyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-4-(4-fluorophenyl)sulfonyl-butan-1-one

Systemtic Name: 1-[4-(6-fluoranyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-4-(4-fluorophenyl)sulfonyl-butan-1-one Openeye Name: 1-[4-(6-fluoro-1,3-benzothiazol-2-yl)piperazin-1-yl]-4-(4-fluorophenyl)sulfonyl-butan-1-one CAS Name: 1-[4-(6-fluoro-1,3-benzothiazol-2-yl)-1-piperazinyl]-4-(4-fluorophenyl)sulfonyl-1-butanone IUPAC Name: 1-[4-(6-fluoro-1,3-benzothiazol-2-yl)piperazin-1-yl]-4-(4-fluorophenyl)sulfonylbutan-1-one Traditional Name: 1-[4-(6-fluoro-1,3-benzothiazol-2-yl)piperazino]-4-(4-fluorophenyl)sulfonyl-butan-1-one Formula: C21H21F2N3O3S2 MolecularWeight: 465.536546

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)F)C(=O)CCCS(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)F)C(=O)CCCS(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H21F2N3O3S2/c22-15-3-6-17(7-4-15)31(28,29)13-1-2-20(27)25-9-11-26(12-10-25)21-24-18-8-5-16(23)14-19(18)30-21/h3-8,14H,1-2,9-13H2