2,2-diethyl-5-(4-methylsulfonylphenyl)-4-pyridin-2-yl-furan-3-one

Systemtic Name: 2,2-diethyl-5-(4-methylsulfonylphenyl)-4-pyridin-2-yl-furan-3-one Openeye Name: 2,2-diethyl-5-(4-methylsulfonylphenyl)-4-(2-pyridyl)furan-3-one CAS Name: 2,2-diethyl-5-(4-methylsulfonylphenyl)-4-(2-pyridinyl)-3-furanone IUPAC Name: 2,2-diethyl-5-(4-methylsulfonylphenyl)-4-pyridin-2-ylfuran-3-one Traditional Name: 2,2-diethyl-5-(4-mesylphenyl)-4-(2-pyridyl)furan-3-one Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)C(=C(O1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=CC=N3)CC

Isomeric SMILES

CCC1(C(=O)C(=C(O1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=CC=N3)CC

InChI

InChI=1S/C20H21NO4S/c1-4-20(5-2)19(22)17(16-8-6-7-13-21-16)18(25-20)14-9-11-15(12-10-14)26(3,23)24/h6-13H,4-5H2,1-3H3