1-[(E)-3-(2-methoxyethanoylamino)-3-methyl-but-1-enyl]-5-(2-methylpropoxy)-N-(5-oxidanyl-2-adamantyl)pyrazole-4-carboxamide

Systemtic Name: 1-[(E)-3-(2-methoxyethanoylamino)-3-methyl-but-1-enyl]-5-(2-methylpropoxy)-N-(5-oxidanyl-2-adamantyl)pyrazole-4-carboxamide Openeye Name: N-(5-hydroxy-2-adamantyl)-5-isobutoxy-1-[(E)-3-[(2-methoxyacetyl)amino]-3-methyl-but-1-enyl]pyrazole-4-carboxamide CAS Name: N-(5-hydroxy-2-adamantyl)-1-[(E)-3-[(2-methoxy-1-oxoethyl)amino]-3-methylbut-1-enyl]-5-(2-methylpropoxy)-4-pyrazolecarboxamide IUPAC Name: N-(5-hydroxy-2-adamantyl)-1-[(E)-3-[(2-methoxyacetyl)amino]-3-methylbut-1-enyl]-5-(2-methylpropoxy)pyrazole-4-carboxamide Traditional Name: N-(5-hydroxy-2-adamantyl)-5-isobutoxy-1-[(E)-3-[(2-methoxyacetyl)amino]-3-methyl-but-1-enyl]pyrazole-4-carboxamide Formula: C26H40N4O5 MolecularWeight: 488.6196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=NN1C=CC(C)(C)NC(=O)COC)C(=O)NC2C3CC4CC2CC(C4)(C3)O

Isomeric SMILES

CC(C)COC1=C(C=NN1/C=C/C(C)(C)NC(=O)COC)C(=O)NC2C3CC4CC2CC(C4)(C3)O

InChI

InChI=1S/C26H40N4O5/c1-16(2)14-35-24-20(13-27-30(24)7-6-25(3,4)29-21(31)15-34-5)23(32)28-22-18-8-17-9-19(22)12-26(33,10-17)11-18/h6-7,13,16-19,22,33H,8-12,14-15H2,1-5H3,(H,28,32)(H,29,31)/b7-6+