N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-5-chloranyl-3-methyl-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-5-chloranyl-3-methyl-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-5-chloro-3-methyl-1-phenyl-pyrazole-4-carboxamide CAS Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-5-chloro-3-methyl-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-5-chloro-3-methyl-1-phenylpyrazole-4-carboxamide Traditional Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-5-chloro-3-methyl-1-phenyl-pyrazole-4-carboxamide Formula: C21H21BrClN3O3 MolecularWeight: 478.76674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCCC2=CC(=C(C=C2Br)OC)OC)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCCC2=CC(=C(C=C2Br)OC)OC)Cl)C3=CC=CC=C3

InChI

InChI=1S/C21H21BrClN3O3/c1-13-19(20(23)26(25-13)15-7-5-4-6-8-15)21(27)24-10-9-14-11-17(28-2)18(29-3)12-16(14)22/h4-8,11-12H,9-10H2,1-3H3,(H,24,27)