2-[(4-chloranyl-3-methyl-1-phenyl-pyrazolo[3,4-b]pyridin-5-yl)carbonylamino]ethyl-diethyl-azanium

Systemtic Name: 2-[(4-chloranyl-3-methyl-1-phenyl-pyrazolo[3,4-b]pyridin-5-yl)carbonylamino]ethyl-diethyl-azanium Openeye Name: 2-[(4-chloro-3-methyl-1-phenyl-pyrazolo[3,4-b]pyridine-5-carbonyl)amino]ethyl-diethyl-ammonium CAS Name: 2-[[(4-chloro-3-methyl-1-phenyl-5-pyrazolo[3,4-b]pyridinyl)-oxomethyl]amino]ethyl-diethylammonium IUPAC Name: 2-[(4-chloro-3-methyl-1-phenylpyrazolo[3,4-b]pyridine-5-carbonyl)amino]ethyl-diethylazanium Traditional Name: 2-[(4-chloro-3-methyl-1-phenyl-pyrazolo[3,4-b]pyridine-5-carbonyl)amino]ethyl-diethyl-ammonium Formula: C20H25ClN5O+ MolecularWeight: 386.8984

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)C1=CN=C2C(=C1Cl)C(=NN2C3=CC=CC=C3)C

Isomeric SMILES

CC[NH+](CC)CCNC(=O)C1=CN=C2C(=C1Cl)C(=NN2C3=CC=CC=C3)C

InChI

InChI=1S/C20H24ClN5O/c1-4-25(5-2)12-11-22-20(27)16-13-23-19-17(18(16)21)14(3)24-26(19)15-9-7-6-8-10-15/h6-10,13H,4-5,11-12H2,1-3H3,(H,22,27)/p+1