N-[1-[(4-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]adamantane-1-carboxamide

Systemtic Name: N-[1-[(4-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]adamantane-1-carboxamide Openeye Name: N-[1-[(4-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]adamantane-1-carboxamide CAS Name: N-[1-[(4-chlorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]-1-adamantanecarboxamide IUPAC Name: N-[1-[(4-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]adamantane-1-carboxamide Traditional Name: N-[1-(4-chlorobenzyl)-3,5-dimethyl-pyrazol-4-yl]adamantane-1-carboxamide Formula: C23H28ClN3O MolecularWeight: 397.94092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)Cl)C)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)Cl)C)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H28ClN3O/c1-14-21(15(2)27(26-14)13-16-3-5-20(24)6-4-16)25-22(28)23-10-17-7-18(11-23)9-19(8-17)12-23/h3-6,17-19H,7-13H2,1-2H3,(H,25,28)