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

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(3-chlorophenyl)-N-(2-cyanoethyl)ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(3-chlorophenyl)-N-(2-cyanoethyl)acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-(3-chlorophenyl)-N-(2-cyanoethyl)acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(3-chlorophenyl)-N-(2-cyanoethyl)acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-(3-chlorophenyl)-N-(2-cyanoethyl)acetamide Formula: C18H14ClN3OS2 MolecularWeight: 387.90626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCC(=O)N(CCC#N)C3=CC(=CC=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCC(=O)N(CCC#N)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H14ClN3OS2/c19-13-5-3-6-14(11-13)22(10-4-9-20)17(23)12-24-18-21-15-7-1-2-8-16(15)25-18/h1-3,5-8,11H,4,10,12H2