2-(1,3-benzothiazol-2-yl)-2-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]ethanenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-2-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]ethanenitrile Openeye Name: 2-(1,3-benzothiazol-2-yl)-2-(2,5-dioxopyrrolidin-1-yl)acetonitrile CAS Name: 2-(1,3-benzothiazol-2-yl)-2-(2,5-dioxo-1-pyrrolidinyl)acetonitrile IUPAC Name: 2-(1,3-benzothiazol-2-yl)-2-(2,5-dioxopyrrolidin-1-yl)acetonitrile Traditional Name: 2-(1,3-benzothiazol-2-yl)-2-succinimido-acetonitrile Formula: C13H9N3O2S MolecularWeight: 271.29446

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1=O)C(C#N)C2=NC3=CC=CC=C3S2

Isomeric SMILES

C1CC(=O)N(C1=O)C(C#N)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C13H9N3O2S/c14-7-9(16-11(17)5-6-12(16)18)13-15-8-3-1-2-4-10(8)19-13/h1-4,9H,5-6H2