1-(3-chlorophenyl)-6-(2-phenoxyethylsulfanyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-(3-chlorophenyl)-6-(2-phenoxyethylsulfanyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-(3-chlorophenyl)-6-(2-phenoxyethylsulfanyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-(3-chlorophenyl)-6-(2-phenoxyethylthio)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-(3-chlorophenyl)-6-(2-phenoxyethylsulfanyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-(3-chlorophenyl)-6-(2-phenoxyethylthio)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C19H15ClN4O2S MolecularWeight: 398.866

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCSC2=NC(=O)C3=CNN(C3=N2)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)OCCSC2=NC(=O)C3=CNN(C3=N2)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C19H15ClN4O2S/c20-13-5-4-6-14(11-13)24-17-16(12-21-24)18(25)23-19(22-17)27-10-9-26-15-7-2-1-3-8-15/h1-8,11-12,21H,9-10H2