1-[6-(4-methylphenyl)pyridazin-3-yl]-6-sulfanylidene-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-[6-(4-methylphenyl)pyridazin-3-yl]-6-sulfanylidene-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-[6-(p-tolyl)pyridazin-3-yl]-6-thioxo-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-[6-(4-methylphenyl)-3-pyridazinyl]-6-sulfanylidene-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-[6-(4-methylphenyl)pyridazin-3-yl]-6-sulfanylidene-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-[6-(p-tolyl)pyridazin-3-yl]-6-thioxo-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C16H12N6OS MolecularWeight: 336.37108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(C=C2)N3C4=NC(=S)NC(=O)C4=CN3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(C=C2)N3C4=NC(=S)NC(=O)C4=CN3

InChI

InChI=1S/C16H12N6OS/c1-9-2-4-10(5-3-9)12-6-7-13(21-20-12)22-14-11(8-17-22)15(23)19-16(24)18-14/h2-8,17H,1H3,(H,19,23,24)