1-[(4-bromanylpyrazol-1-yl)methyl]-N-(5-chloranyl-2-oxidanyl-phenyl)pyrazole-3-carboxamide

Systemtic Name: 1-[(4-bromanylpyrazol-1-yl)methyl]-N-(5-chloranyl-2-oxidanyl-phenyl)pyrazole-3-carboxamide Openeye Name: 1-[(4-bromopyrazol-1-yl)methyl]-N-(5-chloro-2-hydroxy-phenyl)pyrazole-3-carboxamide CAS Name: 1-[(4-bromo-1-pyrazolyl)methyl]-N-(5-chloro-2-hydroxyphenyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromopyrazol-1-yl)methyl]-N-(5-chloro-2-hydroxyphenyl)pyrazole-3-carboxamide Traditional Name: 1-[(4-bromopyrazol-1-yl)methyl]-N-(5-chloro-2-hydroxy-phenyl)pyrazole-3-carboxamide Formula: C14H11BrClN5O2 MolecularWeight: 396.62644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)NC(=O)C2=NN(C=C2)CN3C=C(C=N3)Br)O

Isomeric SMILES

C1=CC(=C(C=C1Cl)NC(=O)C2=NN(C=C2)CN3C=C(C=N3)Br)O

InChI

InChI=1S/C14H11BrClN5O2/c15-9-6-17-21(7-9)8-20-4-3-11(19-20)14(23)18-12-5-10(16)1-2-13(12)22/h1-7,22H,8H2,(H,18,23)