4-(5-chloranylthiophen-2-yl)-5-(4-methylsulfonylphenyl)-2-(phenylmethyl)pyridazin-3-one

Systemtic Name: 4-(5-chloranylthiophen-2-yl)-5-(4-methylsulfonylphenyl)-2-(phenylmethyl)pyridazin-3-one Openeye Name: 2-benzyl-4-(5-chloro-2-thienyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one CAS Name: 4-(5-chloro-2-thiophenyl)-5-(4-methylsulfonylphenyl)-2-(phenylmethyl)-3-pyridazinone IUPAC Name: 2-benzyl-4-(5-chlorothiophen-2-yl)-5-(4-methylsulfonylphenyl)pyridazin-3-one Traditional Name: 2-benzyl-4-(5-chloro-2-thienyl)-5-(4-mesylphenyl)pyridazin-3-one Formula: C22H17ClN2O3S2 MolecularWeight: 456.96498

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)N(N=C2)CC3=CC=CC=C3)C4=CC=C(S4)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)N(N=C2)CC3=CC=CC=C3)C4=CC=C(S4)Cl

InChI

InChI=1S/C22H17ClN2O3S2/c1-30(27,28)17-9-7-16(8-10-17)18-13-24-25(14-15-5-3-2-4-6-15)22(26)21(18)19-11-12-20(23)29-19/h2-13H,14H2,1H3