N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: N-[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]-1-phenyl-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C21H13F3N4O3S MolecularWeight: 458.41313

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CSC(=N3)NC(=O)C4=C(N(N=C4)C5=CC=CC=C5)C(F)(F)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CSC(=N3)NC(=O)C4=C(N(N=C4)C5=CC=CC=C5)C(F)(F)F

InChI

InChI=1S/C21H13F3N4O3S/c22-21(23,24)18-14(9-25-28(18)13-4-2-1-3-5-13)19(29)27-20-26-15(10-32-20)12-6-7-16-17(8-12)31-11-30-16/h1-10H,11H2,(H,26,27,29)