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

Systemtic Name: 5-(4-methylsulfonylphenyl)-2-(phenylmethyl)-4-thiophen-3-yl-pyridazin-3-one Openeye Name: 2-benzyl-5-(4-methylsulfonylphenyl)-4-(3-thienyl)pyridazin-3-one CAS Name: 5-(4-methylsulfonylphenyl)-2-(phenylmethyl)-4-(3-thiophenyl)-3-pyridazinone IUPAC Name: 2-benzyl-5-(4-methylsulfonylphenyl)-4-thiophen-3-ylpyridazin-3-one Traditional Name: 2-benzyl-5-(4-mesylphenyl)-4-(3-thienyl)pyridazin-3-one Formula: C22H18N2O3S2 MolecularWeight: 422.51992

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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=CSC=C4

Isomeric SMILES

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

InChI

InChI=1S/C22H18N2O3S2/c1-29(26,27)19-9-7-17(8-10-19)20-13-23-24(14-16-5-3-2-4-6-16)22(25)21(20)18-11-12-28-15-18/h2-13,15H,14H2,1H3