N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]adamantane-1-carboxamide

Systemtic Name: N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]adamantane-1-carboxamide Openeye Name: N-[3,5-dimethyl-1-(o-tolylmethyl)pyrazol-4-yl]adamantane-1-carboxamide CAS Name: N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]-4-pyrazolyl]-1-adamantanecarboxamide IUPAC Name: N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]adamantane-1-carboxamide Traditional Name: N-[3,5-dimethyl-1-(2-methylbenzyl)pyrazol-4-yl]adamantane-1-carboxamide Formula: C24H31N3O MolecularWeight: 377.52244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C(=C(C(=N2)C)NC(=O)C34CC5CC(C3)CC(C5)C4)C

Isomeric SMILES

CC1=CC=CC=C1CN2C(=C(C(=N2)C)NC(=O)C34CC5CC(C3)CC(C5)C4)C

InChI

InChI=1S/C24H31N3O/c1-15-6-4-5-7-21(15)14-27-17(3)22(16(2)26-27)25-23(28)24-11-18-8-19(12-24)10-20(9-18)13-24/h4-7,18-20H,8-14H2,1-3H3,(H,25,28)