3-(1-adamantyl)-N-[4-bromanyl-1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 3-(1-adamantyl)-N-[4-bromanyl-1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(1-adamantyl)-N-[4-bromo-1-[(2-chloro-6-fluoro-phenyl)methyl]pyrazol-3-yl]-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(1-adamantyl)-N-[4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]-3-pyrazolyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(1-adamantyl)-N-[4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]pyrazol-3-yl]-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(1-adamantyl)-N-[4-bromo-1-(2-chloro-6-fluoro-benzyl)pyrazol-3-yl]-1-phenyl-pyrazole-4-carboxamide Formula: C30H28BrClFN5O MolecularWeight: 608.931623

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=NN(C=C4C(=O)NC5=NN(C=C5Br)CC6=C(C=CC=C6Cl)F)C7=CC=CC=C7

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=NN(C=C4C(=O)NC5=NN(C=C5Br)CC6=C(C=CC=C6Cl)F)C7=CC=CC=C7

InChI

InChI=1S/C30H28BrClFN5O/c31-24-17-37(15-22-25(32)7-4-8-26(22)33)36-28(24)34-29(39)23-16-38(21-5-2-1-3-6-21)35-27(23)30-12-18-9-19(13-30)11-20(10-18)14-30/h1-8,16-20H,9-15H2,(H,34,36,39)