4-phenyl-5-[3-(trifluoromethyl)phenyl]-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: 4-phenyl-5-[3-(trifluoromethyl)phenyl]-3,4-dihydropyrazole-2-carbothioamide Openeye Name: 4-phenyl-5-[3-(trifluoromethyl)phenyl]-3,4-dihydropyrazole-2-carbothioamide CAS Name: 4-phenyl-5-[3-(trifluoromethyl)phenyl]-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: 4-phenyl-5-[3-(trifluoromethyl)phenyl]-3,4-dihydropyrazole-2-carbothioamide Traditional Name: 4-phenyl-3-[3-(trifluoromethyl)phenyl]-2-pyrazoline-1-carbothioamide Formula: C17H14F3N3S MolecularWeight: 349.37337

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=NN1C(=S)N)C2=CC(=CC=C2)C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

C1C(C(=NN1C(=S)N)C2=CC(=CC=C2)C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C17H14F3N3S/c18-17(19,20)13-8-4-7-12(9-13)15-14(10-23(22-15)16(21)24)11-5-2-1-3-6-11/h1-9,14H,10H2,(H2,21,24)