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

Systemtic Name: N-[2-(6-ethylsulfanyl-4-pyrrolidin-1-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-2-methyl-1,3-thiazole-4-carboxamide Openeye Name: N-[2-(6-ethylsulfanyl-4-pyrrolidin-1-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-2-methyl-thiazole-4-carboxamide CAS Name: N-[2-[6-(ethylthio)-4-(1-pyrrolidinyl)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]-2-methyl-4-thiazolecarboxamide IUPAC Name: N-[2-(6-ethylsulfanyl-4-pyrrolidin-1-ylpyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-2-methyl-1,3-thiazole-4-carboxamide Traditional Name: N-[2-[6-(ethylthio)-4-pyrrolidino-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-2-methyl-thiazole-4-carboxamide Formula: C18H23N7OS2 MolecularWeight: 417.55152

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(C=NN2CCNC(=O)C3=CSC(=N3)C)C(=N1)N4CCCC4

Isomeric SMILES

CCSC1=NC2=C(C=NN2CCNC(=O)C3=CSC(=N3)C)C(=N1)N4CCCC4

InChI

InChI=1S/C18H23N7OS2/c1-3-27-18-22-15(24-7-4-5-8-24)13-10-20-25(16(13)23-18)9-6-19-17(26)14-11-28-12(2)21-14/h10-11H,3-9H2,1-2H3,(H,19,26)