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

Systemtic Name: N-[2-[(4-methylphenyl)methyl]pyrazol-3-yl]adamantane-1-carboxamide Openeye Name: N-[2-(p-tolylmethyl)pyrazol-3-yl]adamantane-1-carboxamide CAS Name: N-[2-[(4-methylphenyl)methyl]-3-pyrazolyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[(4-methylphenyl)methyl]pyrazol-3-yl]adamantane-1-carboxamide Traditional Name: N-[2-(4-methylbenzyl)pyrazol-3-yl]adamantane-1-carboxamide Formula: C22H27N3O MolecularWeight: 349.46928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H27N3O/c1-15-2-4-16(5-3-15)14-25-20(6-7-23-25)24-21(26)22-11-17-8-18(12-22)10-19(9-17)13-22/h2-7,17-19H,8-14H2,1H3,(H,24,26)