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

Systemtic Name: 6-(2-diethylaminoethylsulfanyl)-1-(4-methoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-(2-diethylaminoethylsulfanyl)-1-(4-methoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-(2-diethylaminoethylthio)-1-(4-methoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-(2-diethylaminoethylsulfanyl)-1-(4-methoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-(2-diethylaminoethylthio)-1-(4-methoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C18H23N5O2S MolecularWeight: 373.47252

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCSC1=NC(=O)C2=CNN(C2=N1)C3=CC=C(C=C3)OC

Isomeric SMILES

CCN(CC)CCSC1=NC(=O)C2=CNN(C2=N1)C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H23N5O2S/c1-4-22(5-2)10-11-26-18-20-16-15(17(24)21-18)12-19-23(16)13-6-8-14(25-3)9-7-13/h6-9,12,19H,4-5,10-11H2,1-3H3