N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-(cyanomethylsulfanyl)ethanamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-(cyanomethylsulfanyl)ethanamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-(cyanomethylsulfanyl)acetamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-(cyanomethylthio)acetamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-(cyanomethylsulfanyl)acetamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-(cyanomethylthio)acetamide Formula: C17H13N3OS2 MolecularWeight: 339.43462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC(=CC=C3)NC(=O)CSCC#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC(=CC=C3)NC(=O)CSCC#N

InChI

InChI=1S/C17H13N3OS2/c18-8-9-22-11-16(21)19-13-5-3-4-12(10-13)17-20-14-6-1-2-7-15(14)23-17/h1-7,10H,9,11H2,(H,19,21)