(5S)-N-(1-adamantylmethyl)-3-(1-ethyl-5-methyl-pyrazol-4-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide

Systemtic Name: (5S)-N-(1-adamantylmethyl)-3-(1-ethyl-5-methyl-pyrazol-4-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide Openeye Name: (5S)-N-(1-adamantylmethyl)-3-(1-ethyl-5-methyl-pyrazol-4-yl)-4,5-dihydroisoxazole-5-carboxamide CAS Name: (5S)-N-(1-adamantylmethyl)-3-(1-ethyl-5-methyl-4-pyrazolyl)-4,5-dihydroisoxazole-5-carboxamide IUPAC Name: (5S)-N-(1-adamantylmethyl)-3-(1-ethyl-5-methylpyrazol-4-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide Traditional Name: (5S)-N-(1-adamantylmethyl)-3-(1-ethyl-5-methyl-pyrazol-4-yl)-2-isoxazoline-5-carboxamide Formula: C21H30N4O2 MolecularWeight: 370.4885

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)C2=NOC(C2)C(=O)NCC34CC5CC(C3)CC(C5)C4)C

Isomeric SMILES

CCN1C(=C(C=N1)C2=NO[C@@H](C2)C(=O)NCC34CC5CC(C3)CC(C5)C4)C

InChI

InChI=1S/C21H30N4O2/c1-3-25-13(2)17(11-23-25)18-7-19(27-24-18)20(26)22-12-21-8-14-4-15(9-21)6-16(5-14)10-21/h11,14-16,19H,3-10,12H2,1-2H3,(H,22,26)/t14?,15?,16?,19-,21?/m0/s1