(1,3-dimethyl-6-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl)-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]methanone

Systemtic Name: (1,3-dimethyl-6-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl)-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]methanone Openeye Name: (6-isopropyl-1,3-dimethyl-pyrazolo[3,4-b]pyridin-4-yl)-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]methanone CAS Name: (1,3-dimethyl-6-propan-2-yl-4-pyrazolo[3,4-b]pyridinyl)-[(2R)-4-methyl-2-phenyl-1-piperazin-4-iumyl]methanone IUPAC Name: (1,3-dimethyl-6-propan-2-ylpyrazolo[3,4-b]pyridin-4-yl)-[(2R)-4-methyl-2-phenylpiperazin-4-ium-1-yl]methanone Traditional Name: (6-isopropyl-1,3-dimethyl-pyrazolo[3,4-b]pyridin-4-yl)-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]methanone Formula: C23H30N5O+ MolecularWeight: 392.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C(C)C)C(=O)N3CC[NH+](CC3C4=CC=CC=C4)C)C

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C(C)C)C(=O)N3CC[NH+](C[C@H]3C4=CC=CC=C4)C)C

InChI

InChI=1S/C23H29N5O/c1-15(2)19-13-18(21-16(3)25-27(5)22(21)24-19)23(29)28-12-11-26(4)14-20(28)17-9-7-6-8-10-17/h6-10,13,15,20H,11-12,14H2,1-5H3/p+1/t20-/m0/s1