5-[3-(4-ethylpiperazin-1-yl)-3-oxidanylidene-propyl]-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-[3-(4-ethylpiperazin-1-yl)-3-oxidanylidene-propyl]-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[3-(4-ethylpiperazin-1-yl)-3-oxo-propyl]-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[3-(4-ethyl-1-piperazinyl)-3-oxopropyl]-6-methyl-1-phenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[3-(4-ethylpiperazin-1-yl)-3-oxopropyl]-6-methyl-1-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[3-(4-ethylpiperazino)-3-keto-propyl]-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C21H26N6O2 MolecularWeight: 394.47014

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)CCN2C(=NC3=C(C2=O)C=NN3C4=CC=CC=C4)C

Isomeric SMILES

CCN1CCN(CC1)C(=O)CCN2C(=NC3=C(C2=O)C=NN3C4=CC=CC=C4)C

InChI

InChI=1S/C21H26N6O2/c1-3-24-11-13-25(14-12-24)19(28)9-10-26-16(2)23-20-18(21(26)29)15-22-27(20)17-7-5-4-6-8-17/h4-8,15H,3,9-14H2,1-2H3