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

Systemtic Name: 3-(3-chloranyl-1,2,4-triazol-1-yl)-N-(4-cyanophenyl)adamantane-1-carboxamide Openeye Name: 3-(3-chloro-1,2,4-triazol-1-yl)-N-(4-cyanophenyl)adamantane-1-carboxamide CAS Name: 3-(3-chloro-1,2,4-triazol-1-yl)-N-(4-cyanophenyl)-1-adamantanecarboxamide IUPAC Name: 3-(3-chloro-1,2,4-triazol-1-yl)-N-(4-cyanophenyl)adamantane-1-carboxamide Traditional Name: 3-(3-chloro-1,2,4-triazol-1-yl)-N-(4-cyanophenyl)adamantane-1-carboxamide Formula: C20H20ClN5O MolecularWeight: 381.8587

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20ClN5O/c21-18-23-12-26(25-18)20-8-14-5-15(9-20)7-19(6-14,11-20)17(27)24-16-3-1-13(10-22)2-4-16/h1-4,12,14-15H,5-9,11H2,(H,24,27)