N-[2-(6-ethylsulfanyl-4-piperidin-1-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]pent-4-enamide

Systemtic Name: N-[2-(6-ethylsulfanyl-4-piperidin-1-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]pent-4-enamide Openeye Name: N-[2-[6-ethylsulfanyl-4-(1-piperidyl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]pent-4-enamide CAS Name: N-[2-[6-(ethylthio)-4-(1-piperidinyl)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]-4-pentenamide IUPAC Name: N-[2-(6-ethylsulfanyl-4-piperidin-1-ylpyrazolo[3,4-d]pyrimidin-1-yl)ethyl]pent-4-enamide Traditional Name: N-[2-[6-(ethylthio)-4-piperidino-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]pent-4-enamide Formula: C19H28N6OS MolecularWeight: 388.53022

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(C=NN2CCNC(=O)CCC=C)C(=N1)N3CCCCC3

Isomeric SMILES

CCSC1=NC2=C(C=NN2CCNC(=O)CCC=C)C(=N1)N3CCCCC3

InChI

InChI=1S/C19H28N6OS/c1-3-5-9-16(26)20-10-13-25-18-15(14-21-25)17(22-19(23-18)27-4-2)24-11-7-6-8-12-24/h3,14H,1,4-13H2,2H3,(H,20,26)