4-[(3,4-dichlorophenyl)methylsulfanyl]-1-phenyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-[(3,4-dichlorophenyl)methylsulfanyl]-1-phenyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-[(3,4-dichlorophenyl)methylsulfanyl]-1-phenyl-pyrazolo[3,4-d]pyrimidine CAS Name: 4-[(3,4-dichlorophenyl)methylthio]-1-phenylpyrazolo[3,4-d]pyrimidine IUPAC Name: 4-[(3,4-dichlorophenyl)methylsulfanyl]-1-phenylpyrazolo[3,4-d]pyrimidine Traditional Name: 4-[(3,4-dichlorobenzyl)thio]-1-phenyl-pyrazolo[3,4-d]pyrimidine Formula: C18H12Cl2N4S MolecularWeight: 387.28568

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C18H12Cl2N4S/c19-15-7-6-12(8-16(15)20)10-25-18-14-9-23-24(17(14)21-11-22-18)13-4-2-1-3-5-13/h1-9,11H,10H2