6-fluoranyl-2-[2-(4-methylsulfanylphenyl)-5-(trifluoromethyl)pyrazol-3-yl]-1,3-benzothiazole

Systemtic Name: 6-fluoranyl-2-[2-(4-methylsulfanylphenyl)-5-(trifluoromethyl)pyrazol-3-yl]-1,3-benzothiazole Openeye Name: 6-fluoro-2-[2-(4-methylsulfanylphenyl)-5-(trifluoromethyl)pyrazol-3-yl]-1,3-benzothiazole CAS Name: 6-fluoro-2-[2-[4-(methylthio)phenyl]-5-(trifluoromethyl)-3-pyrazolyl]-1,3-benzothiazole IUPAC Name: 6-fluoro-2-[2-(4-methylsulfanylphenyl)-5-(trifluoromethyl)pyrazol-3-yl]-1,3-benzothiazole Traditional Name: 6-fluoro-2-[2-[4-(methylthio)phenyl]-5-(trifluoromethyl)pyrazol-3-yl]-1,3-benzothiazole Formula: C18H11F4N3S2 MolecularWeight: 409.423653

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)N2C(=CC(=N2)C(F)(F)F)C3=NC4=C(S3)C=C(C=C4)F

Isomeric SMILES

CSC1=CC=C(C=C1)N2C(=CC(=N2)C(F)(F)F)C3=NC4=C(S3)C=C(C=C4)F

InChI

InChI=1S/C18H11F4N3S2/c1-26-12-5-3-11(4-6-12)25-14(9-16(24-25)18(20,21)22)17-23-13-7-2-10(19)8-15(13)27-17/h2-9H,1H3