N-benzo[e][1,3]benzothiazol-2-yl-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide

Systemtic Name: N-benzo[e][1,3]benzothiazol-2-yl-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide Openeye Name: N-benzo[e][1,3]benzothiazol-2-yl-9,10,10-trioxo-thioxanthene-3-carboxamide CAS Name: N-(2-benzo[e][1,3]benzothiazolyl)-9,10,10-trioxo-3-thioxanthenecarboxamide IUPAC Name: N-benzo[e][1,3]benzothiazol-2-yl-9,10,10-trioxothioxanthene-3-carboxamide Traditional Name: N-benzo[e][1,3]benzothiazol-2-yl-9,10,10-triketo-thioxanthene-3-carboxamide Formula: C25H14N2O4S2 MolecularWeight: 470.51966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2N=C(S3)NC(=O)C4=CC5=C(C=C4)C(=O)C6=CC=CC=C6S5(=O)=O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2N=C(S3)NC(=O)C4=CC5=C(C=C4)C(=O)C6=CC=CC=C6S5(=O)=O

InChI

InChI=1S/C25H14N2O4S2/c28-23-17-7-3-4-8-20(17)33(30,31)21-13-15(9-11-18(21)23)24(29)27-25-26-22-16-6-2-1-5-14(16)10-12-19(22)32-25/h1-13H,(H,26,27,29)