ethyl 5-ethyl-2-[[9,10,10-tris(oxidanylidene)thioxanthen-3-yl]carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-[[9,10,10-tris(oxidanylidene)thioxanthen-3-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[(9,10,10-trioxothioxanthene-3-carbonyl)amino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[oxo-(9,10,10-trioxo-3-thioxanthenyl)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[(9,10,10-trioxothioxanthene-3-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[(9,10,10-triketothioxanthene-3-carbonyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C23H19NO6S2 MolecularWeight: 469.53006

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O)C(=O)OCC

InChI

InChI=1S/C23H19NO6S2/c1-3-14-12-17(23(27)30-4-2)22(31-14)24-21(26)13-9-10-16-19(11-13)32(28,29)18-8-6-5-7-15(18)20(16)25/h5-12H,3-4H2,1-2H3,(H,24,26)