4-chloranyl-1-(2-chloranyl-2-phenyl-ethyl)-6-propylsulfanyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-chloranyl-1-(2-chloranyl-2-phenyl-ethyl)-6-propylsulfanyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-chloro-1-(2-chloro-2-phenyl-ethyl)-6-propylsulfanyl-pyrazolo[3,4-d]pyrimidine CAS Name: 4-chloro-1-(2-chloro-2-phenylethyl)-6-(propylthio)pyrazolo[3,4-d]pyrimidine IUPAC Name: 4-chloro-1-(2-chloro-2-phenylethyl)-6-propylsulfanylpyrazolo[3,4-d]pyrimidine Traditional Name: 4-chloro-1-(2-chloro-2-phenyl-ethyl)-6-(propylthio)pyrazolo[3,4-d]pyrimidine Formula: C16H16Cl2N4S MolecularWeight: 367.29604

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC2=C(C=NN2CC(C3=CC=CC=C3)Cl)C(=N1)Cl

Isomeric SMILES

CCCSC1=NC2=C(C=NN2CC(C3=CC=CC=C3)Cl)C(=N1)Cl

InChI

InChI=1S/C16H16Cl2N4S/c1-2-8-23-16-20-14(18)12-9-19-22(15(12)21-16)10-13(17)11-6-4-3-5-7-11/h3-7,9,13H,2,8,10H2,1H3