(3R,5S)-N-(1-ethyl-5-methyl-pyrazol-4-yl)-3,5-dimethyl-adamantane-1-carboxamide

Systemtic Name: (3R,5S)-N-(1-ethyl-5-methyl-pyrazol-4-yl)-3,5-dimethyl-adamantane-1-carboxamide Openeye Name: (3R,5S)-N-(1-ethyl-5-methyl-pyrazol-4-yl)-3,5-dimethyl-adamantane-1-carboxamide CAS Name: (3R,5S)-N-(1-ethyl-5-methyl-4-pyrazolyl)-3,5-dimethyl-1-adamantanecarboxamide IUPAC Name: (3R,5S)-N-(1-ethyl-5-methylpyrazol-4-yl)-3,5-dimethyladamantane-1-carboxamide Traditional Name: (3R,5S)-N-(1-ethyl-5-methyl-pyrazol-4-yl)-3,5-dimethyl-adamantane-1-carboxamide Formula: C19H29N3O MolecularWeight: 315.45306

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)NC(=O)C23CC4CC(C2)(CC(C4)(C3)C)C)C

Isomeric SMILES

CCN1C(=C(C=N1)NC(=O)C23CC4C[C@@](C2)(C[C@](C4)(C3)C)C)C

InChI

InChI=1S/C19H29N3O/c1-5-22-13(2)15(9-20-22)21-16(23)19-8-14-6-17(3,11-19)10-18(4,7-14)12-19/h9,14H,5-8,10-12H2,1-4H3,(H,21,23)/t14?,17-,18+,19?