3-[[6-(1H-indazol-4-yl)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]amino]-1-piperazin-1-yl-propan-1-one

Systemtic Name: 3-[[6-(1H-indazol-4-yl)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]amino]-1-piperazin-1-yl-propan-1-one Openeye Name: 3-[[6-(1H-indazol-4-yl)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]amino]-1-piperazin-1-yl-propan-1-one CAS Name: 3-[[6-(1H-indazol-4-yl)-1-methyl-4-pyrazolo[3,4-d]pyrimidinyl]amino]-1-(1-piperazinyl)-1-propanone IUPAC Name: 3-[[6-(1H-indazol-4-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]amino]-1-piperazin-1-ylpropan-1-one Traditional Name: 3-[[6-(1H-indazol-4-yl)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]amino]-1-piperazino-propan-1-one Formula: C20H23N9O MolecularWeight: 405.45632

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC(=N2)C3=C4C=NNC4=CC=C3)NCCC(=O)N5CCNCC5

Isomeric SMILES

CN1C2=C(C=N1)C(=NC(=N2)C3=C4C=NNC4=CC=C3)NCCC(=O)N5CCNCC5

InChI

InChI=1S/C20H23N9O/c1-28-20-15(12-24-28)18(22-6-5-17(30)29-9-7-21-8-10-29)25-19(26-20)13-3-2-4-16-14(13)11-23-27-16/h2-4,11-12,21H,5-10H2,1H3,(H,23,27)(H,22,25,26)