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

Systemtic Name: N-[2-(6-ethylsulfanyl-4-piperidin-1-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-4-methyl-2-pyrrol-1-yl-1,3-thiazole-5-carboxamide Openeye Name: N-[2-[6-ethylsulfanyl-4-(1-piperidyl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-4-methyl-2-pyrrol-1-yl-thiazole-5-carboxamide CAS Name: N-[2-[6-(ethylthio)-4-(1-piperidinyl)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]-4-methyl-2-(1-pyrrolyl)-5-thiazolecarboxamide IUPAC Name: N-[2-(6-ethylsulfanyl-4-piperidin-1-ylpyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-4-methyl-2-pyrrol-1-yl-1,3-thiazole-5-carboxamide Traditional Name: N-[2-[6-(ethylthio)-4-piperidino-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-4-methyl-2-pyrrol-1-yl-thiazole-5-carboxamide Formula: C23H28N8OS2 MolecularWeight: 496.65142

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(C=NN2CCNC(=O)C3=C(N=C(S3)N4C=CC=C4)C)C(=N1)N5CCCCC5

Isomeric SMILES

CCSC1=NC2=C(C=NN2CCNC(=O)C3=C(N=C(S3)N4C=CC=C4)C)C(=N1)N5CCCCC5

InChI

InChI=1S/C23H28N8OS2/c1-3-33-22-27-19(29-10-5-4-6-11-29)17-15-25-31(20(17)28-22)14-9-24-21(32)18-16(2)26-23(34-18)30-12-7-8-13-30/h7-8,12-13,15H,3-6,9-11,14H2,1-2H3,(H,24,32)