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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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