N-[4-(4-bromanylphenoxy)phenyl]-5-methyl-1-(6-oxidanylidene-1H-pyridazin-3-yl)pyrazole-4-carboxamide

Systemtic Name: N-[4-(4-bromanylphenoxy)phenyl]-5-methyl-1-(6-oxidanylidene-1H-pyridazin-3-yl)pyrazole-4-carboxamide Openeye Name: N-[4-(4-bromophenoxy)phenyl]-5-methyl-1-(6-oxo-1H-pyridazin-3-yl)pyrazole-4-carboxamide CAS Name: N-[4-(4-bromophenoxy)phenyl]-5-methyl-1-(6-oxo-1H-pyridazin-3-yl)-4-pyrazolecarboxamide IUPAC Name: N-[4-(4-bromophenoxy)phenyl]-5-methyl-1-(6-oxo-1H-pyridazin-3-yl)pyrazole-4-carboxamide Traditional Name: N-[4-(4-bromophenoxy)phenyl]-1-(6-keto-1H-pyridazin-3-yl)-5-methyl-pyrazole-4-carboxamide Formula: C21H16BrN5O3 MolecularWeight: 466.28744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=NNC(=O)C=C2)C(=O)NC3=CC=C(C=C3)OC4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(C=NN1C2=NNC(=O)C=C2)C(=O)NC3=CC=C(C=C3)OC4=CC=C(C=C4)Br

InChI

InChI=1S/C21H16BrN5O3/c1-13-18(12-23-27(13)19-10-11-20(28)26-25-19)21(29)24-15-4-8-17(9-5-15)30-16-6-2-14(22)3-7-16/h2-12H,1H3,(H,24,29)(H,26,28)