N-[4-[(4-bromanylphenoxy)methyl]phenyl]-6-oxidanylidene-1-(phenylmethyl)pyridazine-3-carboxamide

Systemtic Name: N-[4-[(4-bromanylphenoxy)methyl]phenyl]-6-oxidanylidene-1-(phenylmethyl)pyridazine-3-carboxamide Openeye Name: 1-benzyl-N-[4-[(4-bromophenoxy)methyl]phenyl]-6-oxo-pyridazine-3-carboxamide CAS Name: N-[4-[(4-bromophenoxy)methyl]phenyl]-6-oxo-1-(phenylmethyl)-3-pyridazinecarboxamide IUPAC Name: 1-benzyl-N-[4-[(4-bromophenoxy)methyl]phenyl]-6-oxopyridazine-3-carboxamide Traditional Name: 1-benzyl-N-[4-[(4-bromophenoxy)methyl]phenyl]-6-keto-pyridazine-3-carboxamide Formula: C25H20BrN3O3 MolecularWeight: 490.3486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C=CC(=N2)C(=O)NC3=CC=C(C=C3)COC4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C=CC(=N2)C(=O)NC3=CC=C(C=C3)COC4=CC=C(C=C4)Br

InChI

InChI=1S/C25H20BrN3O3/c26-20-8-12-22(13-9-20)32-17-19-6-10-21(11-7-19)27-25(31)23-14-15-24(30)29(28-23)16-18-4-2-1-3-5-18/h1-15H,16-17H2,(H,27,31)