N-[2-(6-ethylsulfanyl-4-piperidin-1-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide

Systemtic Name: N-[2-(6-ethylsulfanyl-4-piperidin-1-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide Openeye Name: N-[2-[6-ethylsulfanyl-4-(1-piperidyl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-2,4-dimethyl-thiazole-5-carboxamide CAS Name: N-[2-[6-(ethylthio)-4-(1-piperidinyl)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]-2,4-dimethyl-5-thiazolecarboxamide IUPAC Name: N-[2-(6-ethylsulfanyl-4-piperidin-1-ylpyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide Traditional Name: N-[2-[6-(ethylthio)-4-piperidino-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-2,4-dimethyl-thiazole-5-carboxamide Formula: C20H27N7OS2 MolecularWeight: 445.60468

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(C=NN2CCNC(=O)C3=C(N=C(S3)C)C)C(=N1)N4CCCCC4

Isomeric SMILES

CCSC1=NC2=C(C=NN2CCNC(=O)C3=C(N=C(S3)C)C)C(=N1)N4CCCCC4

InChI

InChI=1S/C20H27N7OS2/c1-4-29-20-24-17(26-9-6-5-7-10-26)15-12-22-27(18(15)25-20)11-8-21-19(28)16-13(2)23-14(3)30-16/h12H,4-11H2,1-3H3,(H,21,28)