3-(1-cyclohexyl-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-N-[4-(4-methylpiperazin-1-yl)phenyl]azetidine-1-carboxamide

Systemtic Name: 3-(1-cyclohexyl-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-N-[4-(4-methylpiperazin-1-yl)phenyl]azetidine-1-carboxamide Openeye Name: 3-(1-cyclohexyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-N-[4-(4-methylpiperazin-1-yl)phenyl]azetidine-1-carboxamide CAS Name: 3-(1-cyclohexyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-N-[4-(4-methyl-1-piperazinyl)phenyl]-1-azetidinecarboxamide IUPAC Name: 3-(1-cyclohexyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-N-[4-(4-methylpiperazin-1-yl)phenyl]azetidine-1-carboxamide Traditional Name: 3-(1-cyclohexyl-4-keto-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-N-[4-(4-methylpiperazino)phenyl]azetidine-1-carboxamide Formula: C26H34N8O2 MolecularWeight: 490.60056

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=C(C=C2)NC(=O)N3CC(C3)C4=NC(=O)C5=CNN(C5=N4)C6CCCCC6

Isomeric SMILES

CN1CCN(CC1)C2=CC=C(C=C2)NC(=O)N3CC(C3)C4=NC(=O)C5=CNN(C5=N4)C6CCCCC6

InChI

InChI=1S/C26H34N8O2/c1-31-11-13-32(14-12-31)20-9-7-19(8-10-20)28-26(36)33-16-18(17-33)23-29-24-22(25(35)30-23)15-27-34(24)21-5-3-2-4-6-21/h7-10,15,18,21,27H,2-6,11-14,16-17H2,1H3,(H,28,36)