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

Systemtic Name: 3-(5-bromanyl-2-methoxy-phenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide Openeye Name: 3-(5-bromo-2-methoxy-phenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide CAS Name: 3-(5-bromo-2-methoxyphenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide IUPAC Name: 3-(5-bromo-2-methoxyphenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide Traditional Name: 3-(5-bromo-2-methoxy-phenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide Formula: C13H13BrN4OS MolecularWeight: 353.23752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13BrN4OS/c1-19-10-3-2-7(14)6-9(10)11-8-4-5-16-12(8)18(17-11)13(15)20/h2-3,6,17H,4-5H2,1H3,(H2,15,20)