1-phenyl-N-[5-(4-propan-2-ylphenyl)-1,3,4-thiadiazol-2-yl]-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: 1-phenyl-N-[5-(4-propan-2-ylphenyl)-1,3,4-thiadiazol-2-yl]-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-[5-(4-isopropylphenyl)-1,3,4-thiadiazol-2-yl]-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: 1-phenyl-N-[5-(4-propan-2-ylphenyl)-1,3,4-thiadiazol-2-yl]-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: 1-phenyl-N-[5-(4-propan-2-ylphenyl)-1,3,4-thiadiazol-2-yl]-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-(5-p-cumenyl-1,3,4-thiadiazol-2-yl)-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C22H18F3N5OS MolecularWeight: 457.47143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C3=C(N(N=C3)C4=CC=CC=C4)C(F)(F)F

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C3=C(N(N=C3)C4=CC=CC=C4)C(F)(F)F

InChI

InChI=1S/C22H18F3N5OS/c1-13(2)14-8-10-15(11-9-14)20-28-29-21(32-20)27-19(31)17-12-26-30(18(17)22(23,24)25)16-6-4-3-5-7-16/h3-13H,1-2H3,(H,27,29,31)