2-[(4-chlorophenyl)methyl]-4,5-bis(phenylmethylsulfanyl)pyridazin-3-one

Systemtic Name: 2-[(4-chlorophenyl)methyl]-4,5-bis(phenylmethylsulfanyl)pyridazin-3-one Openeye Name: 4,5-bis(benzylsulfanyl)-2-[(4-chlorophenyl)methyl]pyridazin-3-one CAS Name: 2-[(4-chlorophenyl)methyl]-4,5-bis(phenylmethylthio)-3-pyridazinone IUPAC Name: 4,5-bis(benzylsulfanyl)-2-[(4-chlorophenyl)methyl]pyridazin-3-one Traditional Name: 4,5-bis(benzylthio)-2-(4-chlorobenzyl)pyridazin-3-one Formula: C25H21ClN2OS2 MolecularWeight: 465.03004

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=C(C(=O)N(N=C2)CC3=CC=C(C=C3)Cl)SCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CSC2=C(C(=O)N(N=C2)CC3=CC=C(C=C3)Cl)SCC4=CC=CC=C4

InChI

InChI=1S/C25H21ClN2OS2/c26-22-13-11-19(12-14-22)16-28-25(29)24(31-18-21-9-5-2-6-10-21)23(15-27-28)30-17-20-7-3-1-4-8-20/h1-15H,16-18H2