N-[1-(1-adamantyl)propyl]-2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propanamide

Systemtic Name: N-[1-(1-adamantyl)propyl]-2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propanamide Openeye Name: N-[1-(1-adamantyl)propyl]-2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propanamide CAS Name: N-[1-(1-adamantyl)propyl]-2-(4-bromo-3,5-dimethyl-1-pyrazolyl)propanamide IUPAC Name: N-[1-(1-adamantyl)propyl]-2-(4-bromo-3,5-dimethylpyrazol-1-yl)propanamide Traditional Name: N-[1-(1-adamantyl)propyl]-2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propionamide Formula: C21H32BrN3O MolecularWeight: 422.40228

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C(C)N4C(=C(C(=N4)C)Br)C

Isomeric SMILES

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C(C)N4C(=C(C(=N4)C)Br)C

InChI

InChI=1S/C21H32BrN3O/c1-5-18(21-9-15-6-16(10-21)8-17(7-15)11-21)23-20(26)14(4)25-13(3)19(22)12(2)24-25/h14-18H,5-11H2,1-4H3,(H,23,26)