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

Systemtic Name: 1-[(4-bromanylphenoxy)methyl]-N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]pyrazole-3-carboxamide Openeye Name: 1-[(4-bromophenoxy)methyl]-N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]pyrazole-3-carboxamide CAS Name: 1-[(4-bromophenoxy)methyl]-N-[1-[(3-chlorophenyl)methyl]-3-pyrazolyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromophenoxy)methyl]-N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]pyrazole-3-carboxamide Traditional Name: 1-[(4-bromophenoxy)methyl]-N-[1-(3-chlorobenzyl)pyrazol-3-yl]pyrazole-3-carboxamide Formula: C21H17BrClN5O2 MolecularWeight: 486.74898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17BrClN5O2/c22-16-4-6-18(7-5-16)30-14-28-10-8-19(25-28)21(29)24-20-9-11-27(26-20)13-15-2-1-3-17(23)12-15/h1-12H,13-14H2,(H,24,26,29)