3-cyano-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)benzamide

Systemtic Name: 3-cyano-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)benzamide Openeye Name: 3-cyano-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)benzamide CAS Name: 3-cyano-N-[2-(methylthio)-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 3-cyano-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)benzamide Traditional Name: 3-cyano-N-[2-(methylthio)-1,3-benzothiazol-6-yl]benzamide Formula: C16H11N3OS2 MolecularWeight: 325.40804

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C16H11N3OS2/c1-21-16-19-13-6-5-12(8-14(13)22-16)18-15(20)11-4-2-3-10(7-11)9-17/h2-8H,1H3,(H,18,20)