4-(3-chlorophenyl)sulfanyl-6-methylsulfanyl-1-phenyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-(3-chlorophenyl)sulfanyl-6-methylsulfanyl-1-phenyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-(3-chlorophenyl)sulfanyl-6-methylsulfanyl-1-phenyl-pyrazolo[3,4-d]pyrimidine CAS Name: 4-[(3-chlorophenyl)thio]-6-(methylthio)-1-phenylpyrazolo[3,4-d]pyrimidine IUPAC Name: 4-(3-chlorophenyl)sulfanyl-6-methylsulfanyl-1-phenylpyrazolo[3,4-d]pyrimidine Traditional Name: 4-[(3-chlorophenyl)thio]-6-(methylthio)-1-phenyl-pyrazolo[3,4-d]pyrimidine Formula: C18H13ClN4S2 MolecularWeight: 384.90562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13ClN4S2/c1-24-18-21-16-15(11-20-23(16)13-7-3-2-4-8-13)17(22-18)25-14-9-5-6-12(19)10-14/h2-11H,1H3