N-(2-adamantyl)-5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)pyrazole-3-carboxamide

Systemtic Name: N-(2-adamantyl)-5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)pyrazole-3-carboxamide Openeye Name: N-(2-adamantyl)-5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)pyrazole-3-carboxamide CAS Name: N-(2-adamantyl)-5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-3-pyrazolecarboxamide IUPAC Name: N-(2-adamantyl)-5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)pyrazole-3-carboxamide Traditional Name: N-(2-adamantyl)-5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)pyrazole-3-carboxamide Formula: C26H24Cl3N3O MolecularWeight: 500.84726

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NC(=O)C4=NN(C(=C4)C5=CC=C(C=C5)Cl)C6=C(C=C(C=C6)Cl)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC(=O)C4=NN(C(=C4)C5=CC=C(C=C5)Cl)C6=C(C=C(C=C6)Cl)Cl

InChI

InChI=1S/C26H24Cl3N3O/c27-19-3-1-16(2-4-19)24-13-22(31-32(24)23-6-5-20(28)12-21(23)29)26(33)30-25-17-8-14-7-15(10-17)11-18(25)9-14/h1-6,12-15,17-18,25H,7-11H2,(H,30,33)