N-[2-(6-ethylsulfanyl-4-pyrrolidin-1-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-5-phenyl-1,3-oxazole-2-carboxamide

Systemtic Name: N-[2-(6-ethylsulfanyl-4-pyrrolidin-1-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-5-phenyl-1,3-oxazole-2-carboxamide Openeye Name: N-[2-(6-ethylsulfanyl-4-pyrrolidin-1-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-5-phenyl-oxazole-2-carboxamide CAS Name: N-[2-[6-(ethylthio)-4-(1-pyrrolidinyl)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]-5-phenyl-2-oxazolecarboxamide IUPAC Name: N-[2-(6-ethylsulfanyl-4-pyrrolidin-1-ylpyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-5-phenyl-1,3-oxazole-2-carboxamide Traditional Name: N-[2-[6-(ethylthio)-4-pyrrolidino-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-5-phenyl-oxazole-2-carboxamide Formula: C23H25N7O2S MolecularWeight: 463.5553

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(C=NN2CCNC(=O)C3=NC=C(O3)C4=CC=CC=C4)C(=N1)N5CCCC5

Isomeric SMILES

CCSC1=NC2=C(C=NN2CCNC(=O)C3=NC=C(O3)C4=CC=CC=C4)C(=N1)N5CCCC5

InChI

InChI=1S/C23H25N7O2S/c1-2-33-23-27-19(29-11-6-7-12-29)17-14-26-30(20(17)28-23)13-10-24-21(31)22-25-15-18(32-22)16-8-4-3-5-9-16/h3-5,8-9,14-15H,2,6-7,10-13H2,1H3,(H,24,31)