2-(phenylmethyl)-4,5-bis(phenylmethylsulfanyl)pyridazin-3-one

Systemtic Name: 2-(phenylmethyl)-4,5-bis(phenylmethylsulfanyl)pyridazin-3-one Openeye Name: 2-benzyl-4,5-bis(benzylsulfanyl)pyridazin-3-one CAS Name: 2-(phenylmethyl)-4,5-bis(phenylmethylthio)-3-pyridazinone IUPAC Name: 2-benzyl-4,5-bis(benzylsulfanyl)pyridazin-3-one Traditional Name: 2-benzyl-4,5-bis(benzylthio)pyridazin-3-one Formula: C25H22N2OS2 MolecularWeight: 430.58498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C(=C(C=N2)SCC3=CC=CC=C3)SCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C(=C(C=N2)SCC3=CC=CC=C3)SCC4=CC=CC=C4

InChI

InChI=1S/C25H22N2OS2/c28-25-24(30-19-22-14-8-3-9-15-22)23(29-18-21-12-6-2-7-13-21)16-26-27(25)17-20-10-4-1-5-11-20/h1-16H,17-19H2