N-(2-cyanoaziridin-1-yl)carbothioylbenzamide

Systemtic Name: N-(2-cyanoaziridin-1-yl)carbothioylbenzamide Openeye Name: N-(2-cyanoaziridine-1-carbothioyl)benzamide CAS Name: N-[(2-cyano-1-aziridinyl)-sulfanylidenemethyl]benzamide IUPAC Name: N-(2-cyanoaziridine-1-carbothioyl)benzamide Traditional Name: N-(2-cyanoethylenimine-1-carbothioyl)benzamide Formula: C11H9N3OS MolecularWeight: 231.27366

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N1C(=S)NC(=O)C2=CC=CC=C2)C#N

Isomeric SMILES

C1C(N1C(=S)NC(=O)C2=CC=CC=C2)C#N

InChI

InChI=1S/C11H9N3OS/c12-6-9-7-14(9)11(16)13-10(15)8-4-2-1-3-5-8/h1-5,9H,7H2,(H,13,15,16)