(2E)-N-cyano-2-(3-oxidanylideneisoindol-1-ylidene)-N-phenyl-ethanethioamide

Systemtic Name: (2E)-N-cyano-2-(3-oxidanylideneisoindol-1-ylidene)-N-phenyl-ethanethioamide Openeye Name: (2E)-N-cyano-2-(3-oxoisoindolin-1-ylidene)-N-phenyl-thioacetamide CAS Name: (2E)-N-cyano-2-(3-oxo-1-isoindolylidene)-N-phenylethanethioamide IUPAC Name: (2E)-N-cyano-2-(3-oxoisoindol-1-ylidene)-N-phenylethanethioamide Traditional Name: (2E)-N-cyano-2-(3-ketoisoindolin-1-ylidene)-N-phenyl-thioacetamide Formula: C17H11N3OS MolecularWeight: 305.35374

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(C#N)C(=S)C=C2C3=CC=CC=C3C(=O)N2

Isomeric SMILES

C1=CC=C(C=C1)N(C#N)C(=S)/C=C/2\C3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C17H11N3OS/c18-11-20(12-6-2-1-3-7-12)16(22)10-15-13-8-4-5-9-14(13)17(21)19-15/h1-10H,(H,19,21)/b15-10+