6-[(3,4-dichlorophenyl)methylsulfanyl]-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-[(3,4-dichlorophenyl)methylsulfanyl]-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-[(3,4-dichlorophenyl)methylsulfanyl]-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[(3,4-dichlorophenyl)methylthio]-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-[(3,4-dichlorophenyl)methylsulfanyl]-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-[(3,4-dichlorobenzyl)thio]-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one Formula: C12H8Cl2N4OS MolecularWeight: 327.18912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CSC2=NC(=O)C3=CNNC3=N2)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1CSC2=NC(=O)C3=CNNC3=N2)Cl)Cl

InChI

InChI=1S/C12H8Cl2N4OS/c13-8-2-1-6(3-9(8)14)5-20-12-16-10-7(4-15-18-10)11(19)17-12/h1-4H,5H2,(H2,15,16,17,18,19)