N-[(2-chlorophenyl)methyl]-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide Openeye Name: N-[(2-chlorophenyl)methyl]-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide CAS Name: N-[(2-chlorophenyl)methyl]-3-(1,2,4-triazol-1-yl)-1-adamantanecarboxamide IUPAC Name: N-[(2-chlorophenyl)methyl]-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide Traditional Name: N-(2-chlorobenzyl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide Formula: C20H23ClN4O MolecularWeight: 370.87582

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)N4C=NC=N4)C(=O)NCC5=CC=CC=C5Cl

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)N4C=NC=N4)C(=O)NCC5=CC=CC=C5Cl

InChI

InChI=1S/C20H23ClN4O/c21-17-4-2-1-3-16(17)10-23-18(26)19-6-14-5-15(7-19)9-20(8-14,11-19)25-13-22-12-24-25/h1-4,12-15H,5-11H2,(H,23,26)