N-(1-adamantyl)-5-(2-morpholin-4-ylethoxy)-1-(4-propan-2-ylphenyl)pyrazole-4-carboxamide

Systemtic Name: N-(1-adamantyl)-5-(2-morpholin-4-ylethoxy)-1-(4-propan-2-ylphenyl)pyrazole-4-carboxamide Openeye Name: N-(1-adamantyl)-1-(4-isopropylphenyl)-5-(2-morpholinoethoxy)pyrazole-4-carboxamide CAS Name: N-(1-adamantyl)-5-[2-(4-morpholinyl)ethoxy]-1-(4-propan-2-ylphenyl)-4-pyrazolecarboxamide IUPAC Name: N-(1-adamantyl)-5-(2-morpholin-4-ylethoxy)-1-(4-propan-2-ylphenyl)pyrazole-4-carboxamide Traditional Name: N-(1-adamantyl)-5-(2-morpholinoethoxy)-1-p-cumenyl-pyrazole-4-carboxamide Formula: C29H40N4O3 MolecularWeight: 492.6529

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NC34CC5CC(C3)CC(C5)C4)OCCN6CCOCC6

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NC34CC5CC(C3)CC(C5)C4)OCCN6CCOCC6

InChI

InChI=1S/C29H40N4O3/c1-20(2)24-3-5-25(6-4-24)33-28(36-12-9-32-7-10-35-11-8-32)26(19-30-33)27(34)31-29-16-21-13-22(17-29)15-23(14-21)18-29/h3-6,19-23H,7-18H2,1-2H3,(H,31,34)