5-(4-chlorophenyl)-4-isocyanato-4-methyl-N-[4-(trifluoromethyl)phenyl]-3H-pyrazole-2-carboxamide

Systemtic Name: 5-(4-chlorophenyl)-4-isocyanato-4-methyl-N-[4-(trifluoromethyl)phenyl]-3H-pyrazole-2-carboxamide Openeye Name: 5-(4-chlorophenyl)-4-isocyanato-4-methyl-N-[4-(trifluoromethyl)phenyl]-3H-pyrazole-2-carboxamide CAS Name: 5-(4-chlorophenyl)-4-isocyanato-4-methyl-N-[4-(trifluoromethyl)phenyl]-3H-pyrazole-2-carboxamide IUPAC Name: 5-(4-chlorophenyl)-4-isocyanato-4-methyl-N-[4-(trifluoromethyl)phenyl]-3H-pyrazole-2-carboxamide Traditional Name: 3-(4-chlorophenyl)-4-isocyanato-4-methyl-N-[4-(trifluoromethyl)phenyl]-2-pyrazoline-1-carboxamide Formula: C19H14ClF3N4O2 MolecularWeight: 422.78827

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)C(F)(F)F)N=C=O

Isomeric SMILES

CC1(CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)C(F)(F)F)N=C=O

InChI

InChI=1S/C19H14ClF3N4O2/c1-18(24-11-28)10-27(26-16(18)12-2-6-14(20)7-3-12)17(29)25-15-8-4-13(5-9-15)19(21,22)23/h2-9H,10H2,1H3,(H,25,29)