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

Systemtic Name: 3-(1-adamantyl)-N-[3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(1-adamantyl)-N-[3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(1-adamantyl)-N-[3-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]phenyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(1-adamantyl)-N-[3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]phenyl]-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(1-adamantyl)-N-[3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-1-phenyl-pyrazole-4-carboxamide Formula: C32H34BrN5O MolecularWeight: 584.54926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC(=CC=C2)NC(=O)C3=CN(N=C3C45CC6CC(C4)CC(C6)C5)C7=CC=CC=C7)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC(=CC=C2)NC(=O)C3=CN(N=C3C45CC6CC(C4)CC(C6)C5)C7=CC=CC=C7)C)Br

InChI

InChI=1S/C32H34BrN5O/c1-20-29(33)21(2)37(35-20)18-22-7-6-8-26(14-22)34-31(39)28-19-38(27-9-4-3-5-10-27)36-30(28)32-15-23-11-24(16-32)13-25(12-23)17-32/h3-10,14,19,23-25H,11-13,15-18H2,1-2H3,(H,34,39)