2-[(E)-1-cyanoprop-1-en-2-yl]-1,3-bis(oxidanylidene)-N-(1,3-thiazol-2-yl)isoindole-5-carboxamide

Systemtic Name: 2-[(E)-1-cyanoprop-1-en-2-yl]-1,3-bis(oxidanylidene)-N-(1,3-thiazol-2-yl)isoindole-5-carboxamide Openeye Name: 2-[(E)-2-cyano-1-methyl-vinyl]-1,3-dioxo-N-thiazol-2-yl-isoindoline-5-carboxamide CAS Name: 2-[(E)-1-cyanoprop-1-en-2-yl]-1,3-dioxo-N-(2-thiazolyl)-5-isoindolecarboxamide IUPAC Name: 2-[(E)-1-cyanoprop-1-en-2-yl]-1,3-dioxo-N-(1,3-thiazol-2-yl)isoindole-5-carboxamide Traditional Name: 2-[(E)-2-cyano-1-methyl-vinyl]-1,3-diketo-N-thiazol-2-yl-isoindoline-5-carboxamide Formula: C16H10N4O3S MolecularWeight: 338.3406

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC#N)N1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=NC=CS3

Isomeric SMILES

C/C(=C\C#N)/N1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=NC=CS3

InChI

InChI=1S/C16H10N4O3S/c1-9(4-5-17)20-14(22)11-3-2-10(8-12(11)15(20)23)13(21)19-16-18-6-7-24-16/h2-4,6-8H,1H3,(H,18,19,21)/b9-4+