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

Systemtic Name: 3-(4-bromanyl-3-nitro-pyrazol-1-yl)-N-[1-[(3-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]propanamide Openeye Name: 3-(4-bromo-3-nitro-pyrazol-1-yl)-N-[1-[(3-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]propanamide CAS Name: 3-(4-bromo-3-nitro-1-pyrazolyl)-N-[1-[(3-chlorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]propanamide IUPAC Name: 3-(4-bromo-3-nitropyrazol-1-yl)-N-[1-[(3-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]propanamide Traditional Name: 3-(4-bromo-3-nitro-pyrazol-1-yl)-N-[1-(3-chlorobenzyl)-3,5-dimethyl-pyrazol-4-yl]propionamide 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)CCN3C=C(C(=N3)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC(=CC=C2)Cl)C)NC(=O)CCN3C=C(C(=N3)[N+](=O)[O-])Br

InChI

InChI=1S/C18H18BrClN6O3/c1-11-17(12(2)25(22-11)9-13-4-3-5-14(20)8-13)21-16(27)6-7-24-10-15(19)18(23-24)26(28)29/h3-5,8,10H,6-7,9H2,1-2H3,(H,21,27)