3-[4-(trifluoromethyl)phenyl]-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide

Systemtic Name: 3-[4-(trifluoromethyl)phenyl]-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide Openeye Name: 3-[4-(trifluoromethyl)phenyl]-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide CAS Name: 3-[4-(trifluoromethyl)phenyl]-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide IUPAC Name: 3-[4-(trifluoromethyl)phenyl]-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide Traditional Name: 3-[4-(trifluoromethyl)phenyl]-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide Formula: C13H11F3N4S MolecularWeight: 312.31345

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN=C2C1=C(NN2C(=S)N)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CN=C2C1=C(NN2C(=S)N)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C13H11F3N4S/c14-13(15,16)8-3-1-7(2-4-8)10-9-5-6-18-11(9)20(19-10)12(17)21/h1-4,19H,5-6H2,(H2,17,21)