3-cyano-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]benzenesulfonamide

Systemtic Name: 3-cyano-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]benzenesulfonamide Openeye Name: 3-cyano-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]benzenesulfonamide CAS Name: 3-cyano-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]benzenesulfonamide IUPAC Name: 3-cyano-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]benzenesulfonamide Traditional Name: 3-cyano-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]benzenesulfonamide Formula: C21H15N3O2S2 MolecularWeight: 405.4927

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC(=C4)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C21H15N3O2S2/c1-14-5-10-19-20(11-14)27-21(23-19)16-6-8-17(9-7-16)24-28(25,26)18-4-2-3-15(12-18)13-22/h2-12,24H,1H3