2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-cyanoethyl)ethanamide

Systemtic Name: 2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-cyanoethyl)ethanamide Openeye Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-cyanoethyl)acetamide CAS Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-N-(2-cyanoethyl)acetamide IUPAC Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-cyanoethyl)acetamide Traditional Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-N-(2-cyanoethyl)acetamide Formula: C12H10ClN3OS2 MolecularWeight: 311.8103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)N=C(S2)SCC(=O)NCCC#N

Isomeric SMILES

C1=CC2=C(C=C1Cl)N=C(S2)SCC(=O)NCCC#N

InChI

InChI=1S/C12H10ClN3OS2/c13-8-2-3-10-9(6-8)16-12(19-10)18-7-11(17)15-5-1-4-14/h2-3,6H,1,5,7H2,(H,15,17)