4-[2-(4-ethoxyphenoxy)ethylsulfanyl]-1-methyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-[2-(4-ethoxyphenoxy)ethylsulfanyl]-1-methyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-[2-(4-ethoxyphenoxy)ethylsulfanyl]-1-methyl-pyrazolo[3,4-d]pyrimidine CAS Name: 4-[2-(4-ethoxyphenoxy)ethylthio]-1-methylpyrazolo[3,4-d]pyrimidine IUPAC Name: 4-[2-(4-ethoxyphenoxy)ethylsulfanyl]-1-methylpyrazolo[3,4-d]pyrimidine Traditional Name: 4-[2-(4-ethoxyphenoxy)ethylthio]-1-methyl-pyrazolo[3,4-d]pyrimidine Formula: C16H18N4O2S MolecularWeight: 330.40472

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCSC2=NC=NC3=C2C=NN3C

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCSC2=NC=NC3=C2C=NN3C

InChI

InChI=1S/C16H18N4O2S/c1-3-21-12-4-6-13(7-5-12)22-8-9-23-16-14-10-19-20(2)15(14)17-11-18-16/h4-7,10-11H,3,8-9H2,1-2H3