N-(1-adamantyl)-1-(2,4-dichlorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide

Systemtic Name: N-(1-adamantyl)-1-(2,4-dichlorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Openeye Name: N-(1-adamantyl)-1-(2,4-dichlorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide CAS Name: N-(1-adamantyl)-1-(2,4-dichlorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide IUPAC Name: N-(1-adamantyl)-1-(2,4-dichlorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Traditional Name: N-(1-adamantyl)-1-(2,4-dichlorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Formula: C24H27Cl2N3O MolecularWeight: 444.39668

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=NN2C3=C(C=C(C=C3)Cl)Cl)C(=O)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CCC2=C(C1)C(=NN2C3=C(C=C(C=C3)Cl)Cl)C(=O)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C24H27Cl2N3O/c25-17-5-6-21(19(26)10-17)29-20-4-2-1-3-18(20)22(28-29)23(30)27-24-11-14-7-15(12-24)9-16(8-14)13-24/h5-6,10,14-16H,1-4,7-9,11-13H2,(H,27,30)