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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NC3=CC=CC=C3S2)NS(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=C(C=CC(=C1)C2=NC3=CC=CC=C3S2)NS(=O)(=O)C4=CC=C(C=C4)C#N

InChI

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