4-[2,5-bis(chloranyl)phenyl]sulfanyl-6-methylsulfanyl-1-phenyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-[2,5-bis(chloranyl)phenyl]sulfanyl-6-methylsulfanyl-1-phenyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-(2,5-dichlorophenyl)sulfanyl-6-methylsulfanyl-1-phenyl-pyrazolo[3,4-d]pyrimidine CAS Name: 4-[(2,5-dichlorophenyl)thio]-6-(methylthio)-1-phenylpyrazolo[3,4-d]pyrimidine IUPAC Name: 4-(2,5-dichlorophenyl)sulfanyl-6-methylsulfanyl-1-phenylpyrazolo[3,4-d]pyrimidine Traditional Name: 4-[(2,5-dichlorophenyl)thio]-6-(methylthio)-1-phenyl-pyrazolo[3,4-d]pyrimidine Formula: C18H12Cl2N4S2 MolecularWeight: 419.35068

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)SC4=C(C=CC(=C4)Cl)Cl

Isomeric SMILES

CSC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)SC4=C(C=CC(=C4)Cl)Cl

InChI

InChI=1S/C18H12Cl2N4S2/c1-25-18-22-16-13(10-21-24(16)12-5-3-2-4-6-12)17(23-18)26-15-9-11(19)7-8-14(15)20/h2-10H,1H3