(3R,5S)-3,5-dimethyl-N-[3-(4-methylpyrazol-1-yl)propyl]adamantane-1-carboxamide

Systemtic Name: (3R,5S)-3,5-dimethyl-N-[3-(4-methylpyrazol-1-yl)propyl]adamantane-1-carboxamide Openeye Name: (3R,5S)-3,5-dimethyl-N-[3-(4-methylpyrazol-1-yl)propyl]adamantane-1-carboxamide CAS Name: (3R,5S)-3,5-dimethyl-N-[3-(4-methyl-1-pyrazolyl)propyl]-1-adamantanecarboxamide IUPAC Name: (3R,5S)-3,5-dimethyl-N-[3-(4-methylpyrazol-1-yl)propyl]adamantane-1-carboxamide Traditional Name: (3R,5S)-3,5-dimethyl-N-[3-(4-methylpyrazol-1-yl)propyl]adamantane-1-carboxamide Formula: C20H31N3O MolecularWeight: 329.47964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(N=C1)CCCNC(=O)C23CC4CC(C2)(CC(C4)(C3)C)C

Isomeric SMILES

CC1=CN(N=C1)CCCNC(=O)C23CC4C[C@@](C2)(C[C@](C4)(C3)C)C

InChI

InChI=1S/C20H31N3O/c1-15-10-22-23(11-15)6-4-5-21-17(24)20-9-16-7-18(2,13-20)12-19(3,8-16)14-20/h10-11,16H,4-9,12-14H2,1-3H3,(H,21,24)/t16?,18-,19+,20?