N-[5-(5-chloranyl-3-methyl-1-benzothiophen-2-yl)-2-methyl-pyrazol-3-yl]-4-(trifluoromethyl)benzamide

Systemtic Name: N-[5-(5-chloranyl-3-methyl-1-benzothiophen-2-yl)-2-methyl-pyrazol-3-yl]-4-(trifluoromethyl)benzamide Openeye Name: N-[5-(5-chloro-3-methyl-benzothiophen-2-yl)-2-methyl-pyrazol-3-yl]-4-(trifluoromethyl)benzamide CAS Name: N-[5-(5-chloro-3-methyl-1-benzothiophen-2-yl)-2-methyl-3-pyrazolyl]-4-(trifluoromethyl)benzamide IUPAC Name: N-[5-(5-chloro-3-methyl-1-benzothiophen-2-yl)-2-methylpyrazol-3-yl]-4-(trifluoromethyl)benzamide Traditional Name: N-[5-(5-chloro-3-methyl-benzothiophen-2-yl)-2-methyl-pyrazol-3-yl]-4-(trifluoromethyl)benzamide Formula: C21H15ClF3N3OS MolecularWeight: 449.87651

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)Cl)C3=NN(C(=C3)NC(=O)C4=CC=C(C=C4)C(F)(F)F)C

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)Cl)C3=NN(C(=C3)NC(=O)C4=CC=C(C=C4)C(F)(F)F)C

InChI

InChI=1S/C21H15ClF3N3OS/c1-11-15-9-14(22)7-8-17(15)30-19(11)16-10-18(28(2)27-16)26-20(29)12-3-5-13(6-4-12)21(23,24)25/h3-10H,1-2H3,(H,26,29)