1-(1-adamantyl)-N-[4-bromanyl-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]-4-nitro-pyrazole-3-carboxamide

Systemtic Name: 1-(1-adamantyl)-N-[4-bromanyl-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]-4-nitro-pyrazole-3-carboxamide Openeye Name: 1-(1-adamantyl)-N-[4-bromo-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]-4-nitro-pyrazole-3-carboxamide CAS Name: 1-(1-adamantyl)-N-[4-bromo-1-[(3,4-dichlorophenyl)methyl]-3-pyrazolyl]-4-nitro-3-pyrazolecarboxamide IUPAC Name: 1-(1-adamantyl)-N-[4-bromo-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]-4-nitropyrazole-3-carboxamide Traditional Name: 1-(1-adamantyl)-N-[4-bromo-1-(3,4-dichlorobenzyl)pyrazol-3-yl]-4-nitro-pyrazole-3-carboxamide Formula: C24H23BrCl2N6O3 MolecularWeight: 594.28782

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)N4C=C(C(=N4)C(=O)NC5=NN(C=C5Br)CC6=CC(=C(C=C6)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)N4C=C(C(=N4)C(=O)NC5=NN(C=C5Br)CC6=CC(=C(C=C6)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C24H23BrCl2N6O3/c25-17-11-31(10-13-1-2-18(26)19(27)6-13)30-22(17)28-23(34)21-20(33(35)36)12-32(29-21)24-7-14-3-15(8-24)5-16(4-14)9-24/h1-2,6,11-12,14-16H,3-5,7-10H2,(H,28,30,34)