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

Systemtic Name: N-[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]adamantane-1-carboxamide Openeye Name: N-[5-(p-tolyl)-1H-1,2,4-triazol-3-yl]adamantane-1-carboxamide CAS Name: N-[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]-1-adamantanecarboxamide IUPAC Name: N-[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]adamantane-1-carboxamide Traditional Name: N-[5-(p-tolyl)-1H-1,2,4-triazol-3-yl]adamantane-1-carboxamide Formula: C20H24N4O MolecularWeight: 336.43076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NN2)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NN2)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C20H24N4O/c1-12-2-4-16(5-3-12)17-21-19(24-23-17)22-18(25)20-9-13-6-14(10-20)8-15(7-13)11-20/h2-5,13-15H,6-11H2,1H3,(H2,21,22,23,24,25)