4-(benzotriazol-1-ylmethyl)-N-isoquinolin-5-yl-benzamide

Systemtic Name: 4-(benzotriazol-1-ylmethyl)-N-isoquinolin-5-yl-benzamide Openeye Name: 4-(benzotriazol-1-ylmethyl)-N-(5-isoquinolyl)benzamide CAS Name: 4-(1-benzotriazolylmethyl)-N-(5-isoquinolinyl)benzamide IUPAC Name: 4-(benzotriazol-1-ylmethyl)-N-isoquinolin-5-ylbenzamide Traditional Name: 4-(benzotriazol-1-ylmethyl)-N-(5-isoquinolyl)benzamide Formula: C23H17N5O MolecularWeight: 379.41398

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2CC3=CC=C(C=C3)C(=O)NC4=CC=CC5=C4C=CN=C5

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2CC3=CC=C(C=C3)C(=O)NC4=CC=CC5=C4C=CN=C5

InChI

InChI=1S/C23H17N5O/c29-23(25-20-6-3-4-18-14-24-13-12-19(18)20)17-10-8-16(9-11-17)15-28-22-7-2-1-5-21(22)26-27-28/h1-14H,15H2,(H,25,29)