N-[2-(4-ethoxy-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-[2-(4-ethoxy-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-3-(trifluoromethyl)benzamide Openeye Name: N-[2-(4-ethoxy-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-3-(trifluoromethyl)benzamide CAS Name: N-[2-(4-ethoxy-1,3-benzothiazol-2-yl)-5-methyl-3-pyrazolyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[2-(4-ethoxy-1,3-benzothiazol-2-yl)-5-methylpyrazol-3-yl]-3-(trifluoromethyl)benzamide Traditional Name: N-[2-(4-ethoxy-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-3-(trifluoromethyl)benzamide Formula: C21H17F3N4O2S MolecularWeight: 446.44549

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC=C1)SC(=N2)N3C(=CC(=N3)C)NC(=O)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

CCOC1=C2C(=CC=C1)SC(=N2)N3C(=CC(=N3)C)NC(=O)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C21H17F3N4O2S/c1-3-30-15-8-5-9-16-18(15)26-20(31-16)28-17(10-12(2)27-28)25-19(29)13-6-4-7-14(11-13)21(22,23)24/h4-11H,3H2,1-2H3,(H,25,29)