ethyl 4-thiophen-2-yl-2-[[9,10,10-tris(oxidanylidene)thioxanthen-3-yl]carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-thiophen-2-yl-2-[[9,10,10-tris(oxidanylidene)thioxanthen-3-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(2-thienyl)-2-[(9,10,10-trioxothioxanthene-3-carbonyl)amino]thiophene-3-carboxylate CAS Name: 2-[[oxo-(9,10,10-trioxo-3-thioxanthenyl)methyl]amino]-4-thiophen-2-yl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-thiophen-2-yl-2-[(9,10,10-trioxothioxanthene-3-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 4-(2-thienyl)-2-[(9,10,10-triketothioxanthene-3-carbonyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C25H17NO6S3 MolecularWeight: 523.60058

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CS2)NC(=O)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5S4(=O)=O

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CS2)NC(=O)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5S4(=O)=O

InChI

InChI=1S/C25H17NO6S3/c1-2-32-25(29)21-17(18-7-5-11-33-18)13-34-24(21)26-23(28)14-9-10-16-20(12-14)35(30,31)19-8-4-3-6-15(19)22(16)27/h3-13H,2H2,1H3,(H,26,28)