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

Systemtic Name: N-(4-methoxy-1,3-benzothiazol-2-yl)-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-(4-methoxy-1,3-benzothiazol-2-yl)-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: N-(4-methoxy-1,3-benzothiazol-2-yl)-1-phenyl-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: N-(4-methoxy-1,3-benzothiazol-2-yl)-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-(4-methoxy-1,3-benzothiazol-2-yl)-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C19H13F3N4O2S MolecularWeight: 418.39233

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=C(N(N=C3)C4=CC=CC=C4)C(F)(F)F

Isomeric SMILES

COC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=C(N(N=C3)C4=CC=CC=C4)C(F)(F)F

InChI

InChI=1S/C19H13F3N4O2S/c1-28-13-8-5-9-14-15(13)24-18(29-14)25-17(27)12-10-23-26(16(12)19(20,21)22)11-6-3-2-4-7-11/h2-10H,1H3,(H,24,25,27)