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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCN2C=CC(=N2)C(=O)NC3=CC(=CC=C3)Br)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCN2C=CC(=N2)C(=O)NC3=CC(=CC=C3)Br)C

InChI

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