3-(3-chloranyl-1,2,4-triazol-1-yl)-N-(3-chlorophenyl)adamantane-1-carboxamide

Systemtic Name: 3-(3-chloranyl-1,2,4-triazol-1-yl)-N-(3-chlorophenyl)adamantane-1-carboxamide Openeye Name: N-(3-chlorophenyl)-3-(3-chloro-1,2,4-triazol-1-yl)adamantane-1-carboxamide CAS Name: N-(3-chlorophenyl)-3-(3-chloro-1,2,4-triazol-1-yl)-1-adamantanecarboxamide IUPAC Name: N-(3-chlorophenyl)-3-(3-chloro-1,2,4-triazol-1-yl)adamantane-1-carboxamide Traditional Name: N-(3-chlorophenyl)-3-(3-chloro-1,2,4-triazol-1-yl)adamantane-1-carboxamide Formula: C19H20Cl2N4O MolecularWeight: 391.2943

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)N4C=NC(=N4)Cl)C(=O)NC5=CC(=CC=C5)Cl

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)N4C=NC(=N4)Cl)C(=O)NC5=CC(=CC=C5)Cl

InChI

InChI=1S/C19H20Cl2N4O/c20-14-2-1-3-15(5-14)23-16(26)18-6-12-4-13(7-18)9-19(8-12,10-18)25-11-22-17(21)24-25/h1-3,5,11-13H,4,6-10H2,(H,23,26)