N-(6-ethyl-1,3-benzothiazol-2-yl)-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-1-phenyl-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C20H15F3N4OS MolecularWeight: 416.41951

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(N(N=C3)C4=CC=CC=C4)C(F)(F)F

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(N(N=C3)C4=CC=CC=C4)C(F)(F)F

InChI

InChI=1S/C20H15F3N4OS/c1-2-12-8-9-15-16(10-12)29-19(25-15)26-18(28)14-11-24-27(17(14)20(21,22)23)13-6-4-3-5-7-13/h3-11H,2H2,1H3,(H,25,26,28)