1-(4-methylphenyl)-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: 1-(4-methylphenyl)-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: 1-(p-tolyl)-N-[3-(2-thioxo-1H-imidazol-3-yl)phenyl]-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: 1-(4-methylphenyl)-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: 1-(4-methylphenyl)-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: 1-(p-tolyl)-N-[3-(2-thioxo-4-imidazolin-1-yl)phenyl]-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C21H16F3N5OS MolecularWeight: 443.44485

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NC3=CC=CC(=C3)N4C=CNC4=S)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NC3=CC=CC(=C3)N4C=CNC4=S)C(F)(F)F

InChI

InChI=1S/C21H16F3N5OS/c1-13-5-7-15(8-6-13)29-18(21(22,23)24)17(12-26-29)19(30)27-14-3-2-4-16(11-14)28-10-9-25-20(28)31/h2-12H,1H3,(H,25,31)(H,27,30)