1-(4-fluorophenyl)-4-(3-phenoxypropylsulfanyl)pyrazolo[3,4-d]pyrimidine

Systemtic Name: 1-(4-fluorophenyl)-4-(3-phenoxypropylsulfanyl)pyrazolo[3,4-d]pyrimidine Openeye Name: 1-(4-fluorophenyl)-4-(3-phenoxypropylsulfanyl)pyrazolo[3,4-d]pyrimidine CAS Name: 1-(4-fluorophenyl)-4-(3-phenoxypropylthio)pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-(4-fluorophenyl)-4-(3-phenoxypropylsulfanyl)pyrazolo[3,4-d]pyrimidine Traditional Name: 1-(4-fluorophenyl)-4-(3-phenoxypropylthio)pyrazolo[3,4-d]pyrimidine Formula: C20H17FN4OS MolecularWeight: 380.438583

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCCSC2=NC=NC3=C2C=NN3C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)OCCCSC2=NC=NC3=C2C=NN3C4=CC=C(C=C4)F

InChI

InChI=1S/C20H17FN4OS/c21-15-7-9-16(10-8-15)25-19-18(13-24-25)20(23-14-22-19)27-12-4-11-26-17-5-2-1-3-6-17/h1-3,5-10,13-14H,4,11-12H2