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

Systemtic Name: N-(2-adamantyl)-3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-2-methyl-propanamide Openeye Name: N-(2-adamantyl)-3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-2-methyl-propanamide CAS Name: N-(2-adamantyl)-3-(4-bromo-3,5-dimethyl-1-pyrazolyl)-2-methylpropanamide IUPAC Name: N-(2-adamantyl)-3-(4-bromo-3,5-dimethylpyrazol-1-yl)-2-methylpropanamide Traditional Name: N-(2-adamantyl)-3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-2-methyl-propionamide Formula: C19H28BrN3O MolecularWeight: 394.34912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(C)C(=O)NC2C3CC4CC(C3)CC2C4)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC(C)C(=O)NC2C3CC4CC(C3)CC2C4)C)Br

InChI

InChI=1S/C19H28BrN3O/c1-10(9-23-12(3)17(20)11(2)22-23)19(24)21-18-15-5-13-4-14(7-15)8-16(18)6-13/h10,13-16,18H,4-9H2,1-3H3,(H,21,24)