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

Systemtic Name: N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)-3-chloranyl-benzamide Openeye Name: N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)-3-chloro-benzamide CAS Name: N-(1-butyl-3-pyrazolo[3,4-b]quinolinyl)-3-chlorobenzamide IUPAC Name: N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)-3-chlorobenzamide Traditional Name: N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)-3-chloro-benzamide Formula: C21H19ClN4O MolecularWeight: 378.85476

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19ClN4O/c1-2-3-11-26-20-17(13-14-7-4-5-10-18(14)23-20)19(25-26)24-21(27)15-8-6-9-16(22)12-15/h4-10,12-13H,2-3,11H2,1H3,(H,24,25,27)