2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-[1-[(3-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]ethanamide

Systemtic Name: 2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-[1-[(3-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]ethanamide Openeye Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-[1-[(3-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]acetamide CAS Name: 2-(4-bromo-5-methyl-3-nitro-1-pyrazolyl)-N-[1-[(3-chlorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]acetamide IUPAC Name: 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[1-[(3-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]acetamide Traditional Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-[1-(3-chlorobenzyl)-3,5-dimethyl-pyrazol-4-yl]acetamide Formula: C18H18BrClN6O3 MolecularWeight: 481.73092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC(=CC=C2)Cl)C)NC(=O)CN3C(=C(C(=N3)[N+](=O)[O-])Br)C

Isomeric SMILES

CC1=C(C(=NN1CC2=CC(=CC=C2)Cl)C)NC(=O)CN3C(=C(C(=N3)[N+](=O)[O-])Br)C

InChI

InChI=1S/C18H18BrClN6O3/c1-10-17(12(3)24(22-10)8-13-5-4-6-14(20)7-13)21-15(27)9-25-11(2)16(19)18(23-25)26(28)29/h4-7H,8-9H2,1-3H3,(H,21,27)