(1-tert-butyl-3-methyl-6-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl)-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: (1-tert-butyl-3-methyl-6-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl)-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-(1-tert-butyl-6-isopropyl-3-methyl-pyrazolo[3,4-b]pyridin-4-yl)methanone CAS Name: (1-tert-butyl-3-methyl-6-propan-2-yl-4-pyrazolo[3,4-b]pyridinyl)-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-(1-tert-butyl-3-methyl-6-propan-2-ylpyrazolo[3,4-b]pyridin-4-yl)methanone Traditional Name: (4-benzylpiperazino)-(1-tert-butyl-6-isopropyl-3-methyl-pyrazolo[3,4-b]pyridin-4-yl)methanone Formula: C26H35N5O MolecularWeight: 433.589

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C(C)C)C(=O)N3CCN(CC3)CC4=CC=CC=C4)C(C)(C)C

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C(C)C)C(=O)N3CCN(CC3)CC4=CC=CC=C4)C(C)(C)C

InChI

InChI=1S/C26H35N5O/c1-18(2)22-16-21(23-19(3)28-31(24(23)27-22)26(4,5)6)25(32)30-14-12-29(13-15-30)17-20-10-8-7-9-11-20/h7-11,16,18H,12-15,17H2,1-6H3