[6-(2-methylphenyl)-1-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [6-(2-methylphenyl)-1-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [1-isopropyl-6-(o-tolyl)pyrazolo[3,4-b]pyridin-4-yl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [6-(2-methylphenyl)-1-propan-2-yl-4-pyrazolo[3,4-b]pyridinyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [6-(2-methylphenyl)-1-propan-2-ylpyrazolo[3,4-b]pyridin-4-yl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [1-isopropyl-6-(o-tolyl)pyrazolo[3,4-b]pyridin-4-yl]-(4-phenylpiperazino)methanone Formula: C27H29N5O MolecularWeight: 439.55206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC3=C(C=NN3C(C)C)C(=C2)C(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC=C1C2=NC3=C(C=NN3C(C)C)C(=C2)C(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C27H29N5O/c1-19(2)32-26-24(18-28-32)23(17-25(29-26)22-12-8-7-9-20(22)3)27(33)31-15-13-30(14-16-31)21-10-5-4-6-11-21/h4-12,17-19H,13-16H2,1-3H3