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

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide CAS Name: 3-(1,3-benzodioxol-5-yl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide Formula: C13H12N4O2S MolecularWeight: 288.32498

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C2C1=C(NN2C(=S)N)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN=C2C1=C(NN2C(=S)N)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C13H12N4O2S/c14-13(20)17-12-8(3-4-15-12)11(16-17)7-1-2-9-10(5-7)19-6-18-9/h1-2,5,16H,3-4,6H2,(H2,14,20)