2-phenylsulfanylethyl 2-cyanoaziridine-1-carboxylate

Systemtic Name: 2-phenylsulfanylethyl 2-cyanoaziridine-1-carboxylate Openeye Name: 2-phenylsulfanylethyl 2-cyanoaziridine-1-carboxylate CAS Name: 2-cyano-1-aziridinecarboxylic acid 2-(phenylthio)ethyl ester IUPAC Name: 2-phenylsulfanylethyl 2-cyanoaziridine-1-carboxylate Traditional Name: 2-cyanoethylenimine-1-carboxylic acid 2-(phenylthio)ethyl ester Formula: C12H12N2O2S MolecularWeight: 248.30088

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N1C(=O)OCCSC2=CC=CC=C2)C#N

Isomeric SMILES

C1C(N1C(=O)OCCSC2=CC=CC=C2)C#N

InChI

InChI=1S/C12H12N2O2S/c13-8-10-9-14(10)12(15)16-6-7-17-11-4-2-1-3-5-11/h1-5,10H,6-7,9H2