N-[2-[2-(6-ethylsulfanyl-4-piperidin-1-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethylamino]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: N-[2-[2-(6-ethylsulfanyl-4-piperidin-1-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethylamino]-2-oxidanylidene-ethyl]benzamide Openeye Name: N-[2-[2-[6-ethylsulfanyl-4-(1-piperidyl)pyrazolo[3,4-d]pyrimidin-1-yl]ethylamino]-2-oxo-ethyl]benzamide CAS Name: N-[2-[2-[6-(ethylthio)-4-(1-piperidinyl)-1-pyrazolo[3,4-d]pyrimidinyl]ethylamino]-2-oxoethyl]benzamide IUPAC Name: N-[2-[2-(6-ethylsulfanyl-4-piperidin-1-ylpyrazolo[3,4-d]pyrimidin-1-yl)ethylamino]-2-oxoethyl]benzamide Traditional Name: N-[2-[2-[6-(ethylthio)-4-piperidino-pyrazolo[3,4-d]pyrimidin-1-yl]ethylamino]-2-keto-ethyl]benzamide Formula: C23H29N7O2S MolecularWeight: 467.58706

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(C=NN2CCNC(=O)CNC(=O)C3=CC=CC=C3)C(=N1)N4CCCCC4

Isomeric SMILES

CCSC1=NC2=C(C=NN2CCNC(=O)CNC(=O)C3=CC=CC=C3)C(=N1)N4CCCCC4

InChI

InChI=1S/C23H29N7O2S/c1-2-33-23-27-20(29-12-7-4-8-13-29)18-15-26-30(21(18)28-23)14-11-24-19(31)16-25-22(32)17-9-5-3-6-10-17/h3,5-6,9-10,15H,2,4,7-8,11-14,16H2,1H3,(H,24,31)(H,25,32)