N-(1-adamantyl)-1-(cyclohexylmethyl)-2-(2,4-dichlorophenyl)-3-oxidanylidene-pyrazole-4-carboxamide

Systemtic Name: N-(1-adamantyl)-1-(cyclohexylmethyl)-2-(2,4-dichlorophenyl)-3-oxidanylidene-pyrazole-4-carboxamide Openeye Name: N-(1-adamantyl)-1-(cyclohexylmethyl)-2-(2,4-dichlorophenyl)-3-oxo-pyrazole-4-carboxamide CAS Name: N-(1-adamantyl)-1-(cyclohexylmethyl)-2-(2,4-dichlorophenyl)-3-oxo-4-pyrazolecarboxamide IUPAC Name: N-(1-adamantyl)-1-(cyclohexylmethyl)-2-(2,4-dichlorophenyl)-3-oxopyrazole-4-carboxamide Traditional Name: N-(1-adamantyl)-1-(cyclohexylmethyl)-2-(2,4-dichlorophenyl)-3-keto-3-pyrazoline-4-carboxamide Formula: C27H33Cl2N3O2 MolecularWeight: 502.47582

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2C=C(C(=O)N2C3=C(C=C(C=C3)Cl)Cl)C(=O)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CCC(CC1)CN2C=C(C(=O)N2C3=C(C=C(C=C3)Cl)Cl)C(=O)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C27H33Cl2N3O2/c28-21-6-7-24(23(29)11-21)32-26(34)22(16-31(32)15-17-4-2-1-3-5-17)25(33)30-27-12-18-8-19(13-27)10-20(9-18)14-27/h6-7,11,16-20H,1-5,8-10,12-15H2,(H,30,33)