4,5-bis[(4-bromophenyl)methylsulfanyl]-2-phenyl-pyridazin-3-one

Systemtic Name: 4,5-bis[(4-bromophenyl)methylsulfanyl]-2-phenyl-pyridazin-3-one Openeye Name: 4,5-bis[(4-bromophenyl)methylsulfanyl]-2-phenyl-pyridazin-3-one CAS Name: 4,5-bis[(4-bromophenyl)methylthio]-2-phenyl-3-pyridazinone IUPAC Name: 4,5-bis[(4-bromophenyl)methylsulfanyl]-2-phenylpyridazin-3-one Traditional Name: 4,5-bis[(4-bromobenzyl)thio]-2-phenyl-pyridazin-3-one Formula: C24H18Br2N2OS2 MolecularWeight: 574.35052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=C(C=N2)SCC3=CC=C(C=C3)Br)SCC4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C(=C(C=N2)SCC3=CC=C(C=C3)Br)SCC4=CC=C(C=C4)Br

InChI

InChI=1S/C24H18Br2N2OS2/c25-19-10-6-17(7-11-19)15-30-22-14-27-28(21-4-2-1-3-5-21)24(29)23(22)31-16-18-8-12-20(26)13-9-18/h1-14H,15-16H2