2-(3-chlorophenyl)-4-(furan-2-ylmethylsulfanyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one

Systemtic Name: 2-(3-chlorophenyl)-4-(furan-2-ylmethylsulfanyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one Openeye Name: 2-(3-chlorophenyl)-4-(2-furylmethylsulfanyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one CAS Name: 2-(3-chlorophenyl)-4-(2-furanylmethylthio)-5-(4-methylsulfonylphenyl)-3-pyridazinone IUPAC Name: 2-(3-chlorophenyl)-4-(furan-2-ylmethylsulfanyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one Traditional Name: 2-(3-chlorophenyl)-4-(2-furfurylthio)-5-(4-mesylphenyl)pyridazin-3-one Formula: C22H17ClN2O4S2 MolecularWeight: 472.96438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)N(N=C2)C3=CC(=CC=C3)Cl)SCC4=CC=CO4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)N(N=C2)C3=CC(=CC=C3)Cl)SCC4=CC=CO4

InChI

InChI=1S/C22H17ClN2O4S2/c1-31(27,28)19-9-7-15(8-10-19)20-13-24-25(17-5-2-4-16(23)12-17)22(26)21(20)30-14-18-6-3-11-29-18/h2-13H,14H2,1H3