3-azanyl-4-(1-morpholin-4-ylethylideneamino)-2-(phenylcarbonyl)thieno[2,3-b]thiophene-5-carboxylic acid

Systemtic Name: 3-azanyl-4-(1-morpholin-4-ylethylideneamino)-2-(phenylcarbonyl)thieno[2,3-b]thiophene-5-carboxylic acid Openeye Name: 3-amino-2-benzoyl-4-(1-morpholinoethylideneamino)thieno[2,3-b]thiophene-5-carboxylic acid CAS Name: 3-amino-2-benzoyl-4-[1-(4-morpholinyl)ethylideneamino]-5-thieno[2,3-b]thiophenecarboxylic acid IUPAC Name: 3-amino-2-benzoyl-4-(1-morpholin-4-ylethylideneamino)thieno[2,3-b]thiophene-5-carboxylic acid Traditional Name: 3-amino-2-benzoyl-4-(1-morpholinoethylideneamino)thieno[2,3-b]thiophene-5-carboxylic acid Formula: C20H19N3O4S2 MolecularWeight: 429.51256

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC1=C(SC2=C1C(=C(S2)C(=O)C3=CC=CC=C3)N)C(=O)O)N4CCOCC4

Isomeric SMILES

CC(=NC1=C(SC2=C1C(=C(S2)C(=O)C3=CC=CC=C3)N)C(=O)O)N4CCOCC4

InChI

InChI=1S/C20H19N3O4S2/c1-11(23-7-9-27-10-8-23)22-15-13-14(21)17(16(24)12-5-3-2-4-6-12)28-20(13)29-18(15)19(25)26/h2-6H,7-10,21H2,1H3,(H,25,26)