2,6-bis(chloranyl)-N-[3-cyano-4-(imidazol-1-ylmethyl)quinolin-8-yl]benzamide

Systemtic Name: 2,6-bis(chloranyl)-N-[3-cyano-4-(imidazol-1-ylmethyl)quinolin-8-yl]benzamide Openeye Name: 2,6-dichloro-N-[3-cyano-4-(imidazol-1-ylmethyl)-8-quinolyl]benzamide CAS Name: 2,6-dichloro-N-[3-cyano-4-(1-imidazolylmethyl)-8-quinolinyl]benzamide IUPAC Name: 2,6-dichloro-N-[3-cyano-4-(imidazol-1-ylmethyl)quinolin-8-yl]benzamide Traditional Name: 2,6-dichloro-N-[3-cyano-4-(imidazol-1-ylmethyl)-8-quinolyl]benzamide Formula: C21H13Cl2N5O MolecularWeight: 422.26682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=CN=C2C(=C1)NC(=O)C3=C(C=CC=C3Cl)Cl)C#N)CN4C=CN=C4

Isomeric SMILES

C1=CC2=C(C(=CN=C2C(=C1)NC(=O)C3=C(C=CC=C3Cl)Cl)C#N)CN4C=CN=C4

InChI

InChI=1S/C21H13Cl2N5O/c22-16-4-2-5-17(23)19(16)21(29)27-18-6-1-3-14-15(11-28-8-7-25-12-28)13(9-24)10-26-20(14)18/h1-8,10,12H,11H2,(H,27,29)