N-[(3S)-1-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]pyrrolidin-3-yl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-[(3S)-1-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]pyrrolidin-3-yl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-[(3S)-1-[5-(p-tolyl)-1,2,4-oxadiazol-3-yl]pyrrolidin-3-yl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-[(3S)-1-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]-3-pyrrolidinyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine IUPAC Name: N-[(3S)-1-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]pyrrolidin-3-yl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [(3S)-1-[5-(p-tolyl)-1,2,4-oxadiazol-3-yl]pyrrolidin-3-yl]-(1H-pyrazolo[3,4-d]pyrimidin-4-yl)amine Formula: C18H18N8O MolecularWeight: 362.38852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NO2)N3CCC(C3)NC4=NC=NC5=C4C=NN5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NO2)N3CC[C@@H](C3)NC4=NC=NC5=C4C=NN5

InChI

InChI=1S/C18H18N8O/c1-11-2-4-12(5-3-11)17-23-18(25-27-17)26-7-6-13(9-26)22-15-14-8-21-24-16(14)20-10-19-15/h2-5,8,10,13H,6-7,9H2,1H3,(H2,19,20,21,22,24)/t13-/m0/s1