5-chloranyl-2-(4-methylsulfonylphenyl)-3-thiophen-3-yl-pyran-4-one

Systemtic Name: 5-chloranyl-2-(4-methylsulfonylphenyl)-3-thiophen-3-yl-pyran-4-one Openeye Name: 5-chloro-2-(4-methylsulfonylphenyl)-3-(3-thienyl)pyran-4-one CAS Name: 5-chloro-2-(4-methylsulfonylphenyl)-3-(3-thiophenyl)-4-pyranone IUPAC Name: 5-chloro-2-(4-methylsulfonylphenyl)-3-thiophen-3-ylpyran-4-one Traditional Name: 5-chloro-2-(4-mesylphenyl)-3-(3-thienyl)pyran-4-one Formula: C16H11ClO4S2 MolecularWeight: 366.83914

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)C(=CO2)Cl)C3=CSC=C3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)C(=CO2)Cl)C3=CSC=C3

InChI

InChI=1S/C16H11ClO4S2/c1-23(19,20)12-4-2-10(3-5-12)16-14(11-6-7-22-9-11)15(18)13(17)8-21-16/h2-9H,1H3