6-chloranyl-2-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-1,3-benzothiazole

Systemtic Name: 6-chloranyl-2-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-1,3-benzothiazole Openeye Name: 6-chloro-2-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-1,3-benzothiazole CAS Name: 6-chloro-2-[4-[3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]-1,3-benzothiazole IUPAC Name: 6-chloro-2-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-1,3-benzothiazole Traditional Name: 6-chloro-2-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazino]-1,3-benzothiazole Formula: C18H15ClF3N3O2S2 MolecularWeight: 461.90881

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15ClF3N3O2S2/c19-13-4-5-15-16(11-13)28-17(23-15)24-6-8-25(9-7-24)29(26,27)14-3-1-2-12(10-14)18(20,21)22/h1-5,10-11H,6-9H2