(E)-N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-cyano-3-(4-ethylphenyl)prop-2-enamide

Systemtic Name: (E)-N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-cyano-3-(4-ethylphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(1,1-dioxothiolan-3-yl)-3-(4-ethylphenyl)prop-2-enamide CAS Name: (E)-2-cyano-N-(1,1-dioxo-3-thiolanyl)-3-(4-ethylphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(1,1-dioxothiolan-3-yl)-3-(4-ethylphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(1,1-diketothiolan-3-yl)-3-(4-ethylphenyl)acrylamide Formula: C16H18N2O3S MolecularWeight: 318.39072

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C=C(C#N)C(=O)NC2CCS(=O)(=O)C2

Isomeric SMILES

CCC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2CCS(=O)(=O)C2

InChI

InChI=1S/C16H18N2O3S/c1-2-12-3-5-13(6-4-12)9-14(10-17)16(19)18-15-7-8-22(20,21)11-15/h3-6,9,15H,2,7-8,11H2,1H3,(H,18,19)/b14-9+