N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)-3-methyl-benzamide

Systemtic Name: N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)-3-methyl-benzamide Openeye Name: N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)-3-methyl-benzamide CAS Name: N-(1-butyl-3-pyrazolo[3,4-b]quinolinyl)-3-methylbenzamide IUPAC Name: N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)-3-methylbenzamide Traditional Name: N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)-3-methyl-benzamide Formula: C22H22N4O MolecularWeight: 358.43628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=NC3=CC=CC=C3C=C2C(=N1)NC(=O)C4=CC(=CC=C4)C

Isomeric SMILES

CCCCN1C2=NC3=CC=CC=C3C=C2C(=N1)NC(=O)C4=CC(=CC=C4)C

InChI

InChI=1S/C22H22N4O/c1-3-4-12-26-21-18(14-16-9-5-6-11-19(16)23-21)20(25-26)24-22(27)17-10-7-8-15(2)13-17/h5-11,13-14H,3-4,12H2,1-2H3,(H,24,25,27)