2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-cyanoethyl)ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-cyanoethyl)ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-cyanoethyl)acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-(2-cyanoethyl)acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-cyanoethyl)acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-(2-cyanoethyl)acetamide Formula: C12H11N3OS2 MolecularWeight: 277.36524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCC(=O)NCCC#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCC(=O)NCCC#N

InChI

InChI=1S/C12H11N3OS2/c13-6-3-7-14-11(16)8-17-12-15-9-4-1-2-5-10(9)18-12/h1-2,4-5H,3,7-8H2,(H,14,16)