3-(1-adamantyl)-N-[1-(1-adamantyl)propyl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 3-(1-adamantyl)-N-[1-(1-adamantyl)propyl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(1-adamantyl)-N-[1-(1-adamantyl)propyl]-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(1-adamantyl)-N-[1-(1-adamantyl)propyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(1-adamantyl)-N-[1-(1-adamantyl)propyl]-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(1-adamantyl)-N-[1-(1-adamantyl)propyl]-1-phenyl-pyrazole-4-carboxamide Formula: C33H43N3O MolecularWeight: 497.71402

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CN(N=C4C56CC7CC(C5)CC(C7)C6)C8=CC=CC=C8

Isomeric SMILES

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CN(N=C4C56CC7CC(C5)CC(C7)C6)C8=CC=CC=C8

InChI

InChI=1S/C33H43N3O/c1-2-29(32-14-21-8-22(15-32)10-23(9-21)16-32)34-31(37)28-20-36(27-6-4-3-5-7-27)35-30(28)33-17-24-11-25(18-33)13-26(12-24)19-33/h3-7,20-26,29H,2,8-19H2,1H3,(H,34,37)