2-(4-bromanylphenoxy)-N-[2-[(4-methylphenyl)methyl]pyrazol-3-yl]propanamide

Systemtic Name: 2-(4-bromanylphenoxy)-N-[2-[(4-methylphenyl)methyl]pyrazol-3-yl]propanamide Openeye Name: 2-(4-bromophenoxy)-N-[2-(p-tolylmethyl)pyrazol-3-yl]propanamide CAS Name: 2-(4-bromophenoxy)-N-[2-[(4-methylphenyl)methyl]-3-pyrazolyl]propanamide IUPAC Name: 2-(4-bromophenoxy)-N-[2-[(4-methylphenyl)methyl]pyrazol-3-yl]propanamide Traditional Name: 2-(4-bromophenoxy)-N-[2-(4-methylbenzyl)pyrazol-3-yl]propionamide Formula: C20H20BrN3O2 MolecularWeight: 414.2957

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C(C)OC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C(C)OC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H20BrN3O2/c1-14-3-5-16(6-4-14)13-24-19(11-12-22-24)23-20(25)15(2)26-18-9-7-17(21)8-10-18/h3-12,15H,13H2,1-2H3,(H,23,25)