ethyl 4-(4-bromophenyl)-2-(9H-xanthen-9-ylcarbonylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-bromophenyl)-2-(9H-xanthen-9-ylcarbonylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-(4-bromophenyl)-2-(9H-xanthene-9-carbonylamino)thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[[oxo(9H-xanthen-9-yl)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-bromophenyl)-2-(9H-xanthene-9-carbonylamino)thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-(9H-xanthene-9-carbonylamino)thiophene-3-carboxylic acid ethyl ester Formula: C27H20BrNO4S MolecularWeight: 534.421

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

InChI

InChI=1S/C27H20BrNO4S/c1-2-32-27(31)24-20(16-11-13-17(28)14-12-16)15-34-26(24)29-25(30)23-18-7-3-5-9-21(18)33-22-10-6-4-8-19(22)23/h3-15,23H,2H2,1H3,(H,29,30)