4-[2-(4-methoxyphenoxy)ethylsulfanyl]-1-phenyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-[2-(4-methoxyphenoxy)ethylsulfanyl]-1-phenyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-[2-(4-methoxyphenoxy)ethylsulfanyl]-1-phenyl-pyrazolo[3,4-d]pyrimidine CAS Name: 4-[2-(4-methoxyphenoxy)ethylthio]-1-phenylpyrazolo[3,4-d]pyrimidine IUPAC Name: 4-[2-(4-methoxyphenoxy)ethylsulfanyl]-1-phenylpyrazolo[3,4-d]pyrimidine Traditional Name: 4-[2-(4-methoxyphenoxy)ethylthio]-1-phenyl-pyrazolo[3,4-d]pyrimidine Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCCSC2=NC=NC3=C2C=NN3C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)OCCSC2=NC=NC3=C2C=NN3C4=CC=CC=C4

InChI

InChI=1S/C20H18N4O2S/c1-25-16-7-9-17(10-8-16)26-11-12-27-20-18-13-23-24(19(18)21-14-22-20)15-5-3-2-4-6-15/h2-10,13-14H,11-12H2,1H3