1-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-[(3-methoxy-4-prop-2-enoxy-phenyl)methylidene]-4-methyl-2,6-bis(oxidanylidene)pyridine-3-carbonitrile

Systemtic Name: 1-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-[(3-methoxy-4-prop-2-enoxy-phenyl)methylidene]-4-methyl-2,6-bis(oxidanylidene)pyridine-3-carbonitrile Openeye Name: 5-[(4-allyloxy-3-methoxy-phenyl)methylene]-1-(1,1-dioxothiolan-3-yl)-4-methyl-2,6-dioxo-pyridine-3-carbonitrile CAS Name: 1-(1,1-dioxo-3-thiolanyl)-5-[(3-methoxy-4-prop-2-enoxyphenyl)methylidene]-4-methyl-2,6-dioxo-3-pyridinecarbonitrile IUPAC Name: 1-(1,1-dioxothiolan-3-yl)-5-[(3-methoxy-4-prop-2-enoxyphenyl)methylidene]-4-methyl-2,6-dioxopyridine-3-carbonitrile Traditional Name: 5-(4-allyloxy-3-methoxy-benzylidene)-1-(1,1-diketothiolan-3-yl)-2,6-diketo-4-methyl-nicotinonitrile Formula: C22H22N2O6S MolecularWeight: 442.48488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=O)C1=CC2=CC(=C(C=C2)OCC=C)OC)C3CCS(=O)(=O)C3)C#N

Isomeric SMILES

CC1=C(C(=O)N(C(=O)C1=CC2=CC(=C(C=C2)OCC=C)OC)C3CCS(=O)(=O)C3)C#N

InChI

InChI=1S/C22H22N2O6S/c1-4-8-30-19-6-5-15(11-20(19)29-3)10-17-14(2)18(12-23)22(26)24(21(17)25)16-7-9-31(27,28)13-16/h4-6,10-11,16H,1,7-9,13H2,2-3H3