3-chloranyl-N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]adamantane-1-carboxamide

Systemtic Name: 3-chloranyl-N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]adamantane-1-carboxamide Openeye Name: 3-chloro-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]adamantane-1-carboxamide CAS Name: 3-chloro-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-1-adamantanecarboxamide IUPAC Name: 3-chloro-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]adamantane-1-carboxamide Traditional Name: 3-chloro-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]adamantane-1-carboxamide Formula: C19H20Cl2N4O MolecularWeight: 391.2943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)Cl)C(=O)NC4=C(C=CC(=C4)Cl)N5C=NC=N5

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)Cl)C(=O)NC4=C(C=CC(=C4)Cl)N5C=NC=N5

InChI

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