1-[(4-bromanylphenoxy)methyl]-N-[1-[(3-methylphenyl)methyl]pyrazol-3-yl]pyrazole-3-carboxamide

Systemtic Name: 1-[(4-bromanylphenoxy)methyl]-N-[1-[(3-methylphenyl)methyl]pyrazol-3-yl]pyrazole-3-carboxamide Openeye Name: 1-[(4-bromophenoxy)methyl]-N-[1-(m-tolylmethyl)pyrazol-3-yl]pyrazole-3-carboxamide CAS Name: 1-[(4-bromophenoxy)methyl]-N-[1-[(3-methylphenyl)methyl]-3-pyrazolyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromophenoxy)methyl]-N-[1-[(3-methylphenyl)methyl]pyrazol-3-yl]pyrazole-3-carboxamide Traditional Name: 1-[(4-bromophenoxy)methyl]-N-[1-(3-methylbenzyl)pyrazol-3-yl]pyrazole-3-carboxamide Formula: C22H20BrN5O2 MolecularWeight: 466.3305

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=CC(=N2)NC(=O)C3=NN(C=C3)COC4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=CC(=N2)NC(=O)C3=NN(C=C3)COC4=CC=C(C=C4)Br

InChI

InChI=1S/C22H20BrN5O2/c1-16-3-2-4-17(13-16)14-27-12-10-21(26-27)24-22(29)20-9-11-28(25-20)15-30-19-7-5-18(23)6-8-19/h2-13H,14-15H2,1H3,(H,24,26,29)