ethyl (5Z)-5-[[5-bromanyl-1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)indol-3-yl]methylidene]-4-oxidanylidene-2-phenylazanyl-thiophene-3-carboxylate

Systemtic Name: ethyl (5Z)-5-[[5-bromanyl-1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)indol-3-yl]methylidene]-4-oxidanylidene-2-phenylazanyl-thiophene-3-carboxylate Openeye Name: ethyl (5Z)-2-anilino-5-[[5-bromo-1-(2-morpholino-2-oxo-ethyl)indol-3-yl]methylene]-4-oxo-thiophene-3-carboxylate CAS Name: (5Z)-2-anilino-5-[[5-bromo-1-[2-(4-morpholinyl)-2-oxoethyl]-3-indolyl]methylidene]-4-oxo-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl (5Z)-2-anilino-5-[[5-bromo-1-(2-morpholin-4-yl-2-oxoethyl)indol-3-yl]methylidene]-4-oxothiophene-3-carboxylate Traditional Name: (5Z)-2-anilino-5-[[5-bromo-1-(2-keto-2-morpholino-ethyl)indol-3-yl]methylene]-4-keto-thiophene-3-carboxylic acid ethyl ester Formula: C28H26BrN3O5S MolecularWeight: 596.49214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=CC2=CN(C3=C2C=C(C=C3)Br)CC(=O)N4CCOCC4)C1=O)NC5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(S/C(=C\C2=CN(C3=C2C=C(C=C3)Br)CC(=O)N4CCOCC4)/C1=O)NC5=CC=CC=C5

InChI

InChI=1S/C28H26BrN3O5S/c1-2-37-28(35)25-26(34)23(38-27(25)30-20-6-4-3-5-7-20)14-18-16-32(22-9-8-19(29)15-21(18)22)17-24(33)31-10-12-36-13-11-31/h3-9,14-16,30H,2,10-13,17H2,1H3/b23-14-