N-(1,3-benzothiazol-2-yl)-N-(cyanomethyl)benzenesulfonamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(cyanomethyl)benzenesulfonamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-(cyanomethyl)benzenesulfonamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-(cyanomethyl)benzenesulfonamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-(cyanomethyl)benzenesulfonamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-(cyanomethyl)benzenesulfonamide Formula: C15H11N3O2S2 MolecularWeight: 329.39674

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N(CC#N)C2=NC3=CC=CC=C3S2

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N(CC#N)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C15H11N3O2S2/c16-10-11-18(22(19,20)12-6-2-1-3-7-12)15-17-13-8-4-5-9-14(13)21-15/h1-9H,11H2