N-(2-bromophenyl)-1-[(2,4-dimethylphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(2-bromophenyl)-1-[(2,4-dimethylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(2-bromophenyl)-1-[(2,4-dimethylphenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(2-bromophenyl)-1-[(2,4-dimethylphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(2-bromophenyl)-1-[(2,4-dimethylphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(2-bromophenyl)-1-[(2,4-dimethylphenoxy)methyl]pyrazole-3-carboxamide Formula: C19H18BrN3O2 MolecularWeight: 400.26912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCN2C=CC(=N2)C(=O)NC3=CC=CC=C3Br)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCN2C=CC(=N2)C(=O)NC3=CC=CC=C3Br)C

InChI

InChI=1S/C19H18BrN3O2/c1-13-7-8-18(14(2)11-13)25-12-23-10-9-17(22-23)19(24)21-16-6-4-3-5-15(16)20/h3-11H,12H2,1-2H3,(H,21,24)