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

Systemtic Name: N-[1-(1-adamantyl)propyl]-3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propanamide Openeye Name: N-[1-(1-adamantyl)propyl]-3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propanamide CAS Name: N-[1-(1-adamantyl)propyl]-3-(4-bromo-3,5-dimethyl-1-pyrazolyl)propanamide IUPAC Name: N-[1-(1-adamantyl)propyl]-3-(4-bromo-3,5-dimethylpyrazol-1-yl)propanamide Traditional Name: N-[1-(1-adamantyl)propyl]-3-(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)CCN4C(=C(C(=N4)C)Br)C

Isomeric SMILES

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)CCN4C(=C(C(=N4)C)Br)C

InChI

InChI=1S/C21H32BrN3O/c1-4-18(21-10-15-7-16(11-21)9-17(8-15)12-21)23-19(26)5-6-25-14(3)20(22)13(2)24-25/h15-18H,4-12H2,1-3H3,(H,23,26)