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

Systemtic Name: N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)-4-chloranyl-benzamide Openeye Name: N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)-4-chloro-benzamide CAS Name: N-(1-butyl-3-pyrazolo[3,4-b]quinolinyl)-4-chlorobenzamide IUPAC Name: N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)-4-chlorobenzamide Traditional Name: N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)-4-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=C(C=C4)Cl

Isomeric SMILES

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

InChI

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