(1-tert-butyl-6-cyclopropyl-3-methyl-pyrazolo[3,4-b]pyridin-4-yl)-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: (1-tert-butyl-6-cyclopropyl-3-methyl-pyrazolo[3,4-b]pyridin-4-yl)-(4-phenylpiperazin-1-yl)methanone Openeye Name: (1-tert-butyl-6-cyclopropyl-3-methyl-pyrazolo[3,4-b]pyridin-4-yl)-(4-phenylpiperazin-1-yl)methanone CAS Name: (1-tert-butyl-6-cyclopropyl-3-methyl-4-pyrazolo[3,4-b]pyridinyl)-(4-phenyl-1-piperazinyl)methanone IUPAC Name: (1-tert-butyl-6-cyclopropyl-3-methylpyrazolo[3,4-b]pyridin-4-yl)-(4-phenylpiperazin-1-yl)methanone Traditional Name: (1-tert-butyl-6-cyclopropyl-3-methyl-pyrazolo[3,4-b]pyridin-4-yl)-(4-phenylpiperazino)methanone Formula: C25H31N5O MolecularWeight: 417.54654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3CC3)C(=O)N4CCN(CC4)C5=CC=CC=C5)C(C)(C)C

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3CC3)C(=O)N4CCN(CC4)C5=CC=CC=C5)C(C)(C)C

InChI

InChI=1S/C25H31N5O/c1-17-22-20(16-21(18-10-11-18)26-23(22)30(27-17)25(2,3)4)24(31)29-14-12-28(13-15-29)19-8-6-5-7-9-19/h5-9,16,18H,10-15H2,1-4H3