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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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