3-chloranyl-N-[2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]adamantane-1-carboxamide

Systemtic Name: 3-chloranyl-N-[2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]adamantane-1-carboxamide Openeye Name: 3-chloro-N-[2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]adamantane-1-carboxamide CAS Name: 3-chloro-N-[2-[4-(3,5-dimethyl-1-pyrazolyl)phenyl]ethyl]-1-adamantanecarboxamide IUPAC Name: 3-chloro-N-[2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]adamantane-1-carboxamide Traditional Name: 3-chloro-N-[2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]adamantane-1-carboxamide Formula: C24H30ClN3O MolecularWeight: 411.9675

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=C(C=C2)CCNC(=O)C34CC5CC(C3)CC(C5)(C4)Cl)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=C(C=C2)CCNC(=O)C34CC5CC(C3)CC(C5)(C4)Cl)C

InChI

InChI=1S/C24H30ClN3O/c1-16-9-17(2)28(27-16)21-5-3-18(4-6-21)7-8-26-22(29)23-11-19-10-20(12-23)14-24(25,13-19)15-23/h3-6,9,19-20H,7-8,10-15H2,1-2H3,(H,26,29)