N-phenyl-4-[[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]methyl]benzamide

Systemtic Name: N-phenyl-4-[[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]methyl]benzamide Openeye Name: N-phenyl-4-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl]benzamide CAS Name: N-phenyl-4-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl]benzamide IUPAC Name: N-phenyl-4-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl]benzamide Traditional Name: N-phenyl-4-[(1,1,3-triketo-1,2-benzothiazol-2-yl)methyl]benzamide Formula: C21H16N2O4S MolecularWeight: 392.42774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C21H16N2O4S/c24-20(22-17-6-2-1-3-7-17)16-12-10-15(11-13-16)14-23-21(25)18-8-4-5-9-19(18)28(23,26)27/h1-13H,14H2,(H,22,24)