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

Systemtic Name: 3-(1-adamantyl)-N-[3-(4-bromanyl-3-methyl-pyrazol-1-yl)propyl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(1-adamantyl)-N-[3-(4-bromo-3-methyl-pyrazol-1-yl)propyl]-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(1-adamantyl)-N-[3-(4-bromo-3-methyl-1-pyrazolyl)propyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(1-adamantyl)-N-[3-(4-bromo-3-methylpyrazol-1-yl)propyl]-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(1-adamantyl)-N-[3-(4-bromo-3-methyl-pyrazol-1-yl)propyl]-1-phenyl-pyrazole-4-carboxamide Formula: C27H32BrN5O MolecularWeight: 522.47988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1Br)CCCNC(=O)C2=CN(N=C2C34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6

Isomeric SMILES

CC1=NN(C=C1Br)CCCNC(=O)C2=CN(N=C2C34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6

InChI

InChI=1S/C27H32BrN5O/c1-18-24(28)17-32(30-18)9-5-8-29-26(34)23-16-33(22-6-3-2-4-7-22)31-25(23)27-13-19-10-20(14-27)12-21(11-19)15-27/h2-4,6-7,16-17,19-21H,5,8-15H2,1H3,(H,29,34)