3-(5-chloranyl-3-methyl-1-benzothiophen-2-yl)-5-(trifluoromethyl)-1H-pyrazole

Systemtic Name: 3-(5-chloranyl-3-methyl-1-benzothiophen-2-yl)-5-(trifluoromethyl)-1H-pyrazole Openeye Name: 3-(5-chloro-3-methyl-benzothiophen-2-yl)-5-(trifluoromethyl)-1H-pyrazole CAS Name: 3-(5-chloro-3-methyl-1-benzothiophen-2-yl)-5-(trifluoromethyl)-1H-pyrazole IUPAC Name: 3-(5-chloro-3-methyl-1-benzothiophen-2-yl)-5-(trifluoromethyl)-1H-pyrazole Traditional Name: 3-(5-chloro-3-methyl-benzothiophen-2-yl)-5-(trifluoromethyl)-1H-pyrazole Formula: C13H8ClF3N2S MolecularWeight: 316.72923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)Cl)C3=NNC(=C3)C(F)(F)F

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)Cl)C3=NNC(=C3)C(F)(F)F

InChI

InChI=1S/C13H8ClF3N2S/c1-6-8-4-7(14)2-3-10(8)20-12(6)9-5-11(19-18-9)13(15,16)17/h2-5H,1H3,(H,18,19)