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

Systemtic Name: (E)-N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-cyano-3-pyridin-3-yl-prop-2-enamide Openeye Name: (E)-2-cyano-N-[(3S)-1,1-dioxothiolan-3-yl]-3-(3-pyridyl)prop-2-enamide CAS Name: (E)-2-cyano-N-[(3S)-1,1-dioxo-3-thiolanyl]-3-(3-pyridinyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-[(3S)-1,1-dioxothiolan-3-yl]-3-pyridin-3-ylprop-2-enamide Traditional Name: (E)-2-cyano-N-[(3S)-1,1-diketothiolan-3-yl]-3-(3-pyridyl)acrylamide Formula: C13H13N3O3S MolecularWeight: 291.32562

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1NC(=O)C(=CC2=CN=CC=C2)C#N

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1NC(=O)/C(=C/C2=CN=CC=C2)/C#N

InChI

InChI=1S/C13H13N3O3S/c14-7-11(6-10-2-1-4-15-8-10)13(17)16-12-3-5-20(18,19)9-12/h1-2,4,6,8,12H,3,5,9H2,(H,16,17)/b11-6+/t12-/m0/s1