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

Systemtic Name: 3-(3,5-dimethoxyphenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide Openeye Name: 3-(3,5-dimethoxyphenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide CAS Name: 3-(3,5-dimethoxyphenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide IUPAC Name: 3-(3,5-dimethoxyphenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide Traditional Name: 3-(3,5-dimethoxyphenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide Formula: C14H16N4O2S MolecularWeight: 304.36744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C2=C3CCN=C3N(N2)C(=S)N)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C2=C3CCN=C3N(N2)C(=S)N)OC

InChI

InChI=1S/C14H16N4O2S/c1-19-9-5-8(6-10(7-9)20-2)12-11-3-4-16-13(11)18(17-12)14(15)21/h5-7,17H,3-4H2,1-2H3,(H2,15,21)