3-(4-dimethylaminophenyl)-2,5,7-triphenyl-6-sulfanylidene-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 3-(4-dimethylaminophenyl)-2,5,7-triphenyl-6-sulfanylidene-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 3-(4-dimethylaminophenyl)-2,5,7-triphenyl-6-thioxo-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 3-(4-dimethylaminophenyl)-2,5,7-triphenyl-6-sulfanylidene-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 3-(4-dimethylaminophenyl)-2,5,7-triphenyl-6-sulfanylidenepyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 3-(4-dimethylaminophenyl)-2,5,7-triphenyl-6-thioxo-pyrazolo[3,4-d]pyrimidin-4-one Formula: C31H25N5OS MolecularWeight: 515.6281

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=C3C(=NN2C4=CC=CC=C4)N(C(=S)N(C3=O)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=C3C(=NN2C4=CC=CC=C4)N(C(=S)N(C3=O)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C31H25N5OS/c1-33(2)23-20-18-22(19-21-23)28-27-29(32-36(28)26-16-10-5-11-17-26)34(24-12-6-3-7-13-24)31(38)35(30(27)37)25-14-8-4-9-15-25/h3-21H,1-2H3