1-(1-adamantyl)-4-bromanyl-N-[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]pyrazole-3-carboxamide

Systemtic Name: 1-(1-adamantyl)-4-bromanyl-N-[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]pyrazole-3-carboxamide Openeye Name: 1-(1-adamantyl)-4-bromo-N-[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]pyrazole-3-carboxamide CAS Name: 1-(1-adamantyl)-4-bromo-N-[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]-3-pyrazolecarboxamide IUPAC Name: 1-(1-adamantyl)-4-bromo-N-[1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]pyrazole-3-carboxamide Traditional Name: 1-(1-adamantyl)-4-bromo-N-[1-(2-chlorobenzyl)-3,5-dimethyl-pyrazol-4-yl]pyrazole-3-carboxamide Formula: C26H29BrClN5O MolecularWeight: 542.89836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2Cl)C)NC(=O)C3=NN(C=C3Br)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2Cl)C)NC(=O)C3=NN(C=C3Br)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C26H29BrClN5O/c1-15-23(16(2)32(30-15)13-20-5-3-4-6-22(20)28)29-25(34)24-21(27)14-33(31-24)26-10-17-7-18(11-26)9-19(8-17)12-26/h3-6,14,17-19H,7-13H2,1-2H3,(H,29,34)