[(1S)-2-[(6-cyclopropyl-1-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl)carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[(6-cyclopropyl-1-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl)carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(6-cyclopropyl-1-isopropyl-pyrazolo[3,4-b]pyridine-4-carbonyl)amino]-1-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[(6-cyclopropyl-1-propan-2-yl-4-pyrazolo[3,4-b]pyridinyl)-oxomethyl]amino]-1-phenylethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(6-cyclopropyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carbonyl)amino]-1-phenylethyl]-dimethylazanium Traditional Name: [(1S)-2-[(6-cyclopropyl-1-isopropyl-pyrazolo[3,4-b]pyridine-4-carbonyl)amino]-1-phenyl-ethyl]-dimethyl-ammonium Formula: C23H30N5O+ MolecularWeight: 392.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3CC3)C(=O)NCC(C4=CC=CC=C4)[NH+](C)C

Isomeric SMILES

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3CC3)C(=O)NC[C@H](C4=CC=CC=C4)[NH+](C)C

InChI

InChI=1S/C23H29N5O/c1-15(2)28-22-19(13-25-28)18(12-20(26-22)16-10-11-16)23(29)24-14-21(27(3)4)17-8-6-5-7-9-17/h5-9,12-13,15-16,21H,10-11,14H2,1-4H3,(H,24,29)/p+1/t21-/m1/s1