N-(5-piperidin-1-ylisoquinolin-8-yl)-2H-benzotriazole-5-carboxamide

Systemtic Name: N-(5-piperidin-1-ylisoquinolin-8-yl)-2H-benzotriazole-5-carboxamide Openeye Name: N-[5-(1-piperidyl)-8-isoquinolyl]-2H-benzotriazole-5-carboxamide CAS Name: N-[5-(1-piperidinyl)-8-isoquinolinyl]-2H-benzotriazole-5-carboxamide IUPAC Name: N-(5-piperidin-1-ylisoquinolin-8-yl)-2H-benzotriazole-5-carboxamide Traditional Name: N-(5-piperidino-8-isoquinolyl)-2H-benzotriazole-5-carboxamide Formula: C21H20N6O MolecularWeight: 372.4231

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)NC(=O)C4=CC5=NNN=C5C=C4

Isomeric SMILES

C1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)NC(=O)C4=CC5=NNN=C5C=C4

InChI

InChI=1S/C21H20N6O/c28-21(14-4-5-18-19(12-14)25-26-24-18)23-17-6-7-20(27-10-2-1-3-11-27)15-8-9-22-13-16(15)17/h4-9,12-13H,1-3,10-11H2,(H,23,28)(H,24,25,26)