N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-4-cyano-benzenesulfonamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-4-cyano-benzenesulfonamide Openeye Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-4-cyano-benzenesulfonamide CAS Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-4-cyanobenzenesulfonamide IUPAC Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-4-cyanobenzenesulfonamide Traditional Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-4-cyano-benzenesulfonamide Formula: C21H15N3O2S2 MolecularWeight: 405.4927

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CC3=CC=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CC3=CC=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C21H15N3O2S2/c22-14-16-7-11-18(12-8-16)28(25,26)24-17-9-5-15(6-10-17)13-21-23-19-3-1-2-4-20(19)27-21/h1-12,24H,13H2