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

Systemtic Name: N-(1-adamantylmethyl)-3-(1-ethyl-3-methyl-pyrazol-4-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide Openeye Name: N-(1-adamantylmethyl)-3-(1-ethyl-3-methyl-pyrazol-4-yl)-4,5-dihydroisoxazole-5-carboxamide CAS Name: N-(1-adamantylmethyl)-3-(1-ethyl-3-methyl-4-pyrazolyl)-4,5-dihydroisoxazole-5-carboxamide IUPAC Name: N-(1-adamantylmethyl)-3-(1-ethyl-3-methylpyrazol-4-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide Traditional Name: N-(1-adamantylmethyl)-3-(1-ethyl-3-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)C)C2=NOC(C2)C(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

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

InChI

InChI=1S/C21H30N4O2/c1-3-25-11-17(13(2)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)