6-(4-bromophenyl)-4-methyl-3-(1-morpholin-4-ylethylideneamino)thieno[2,3-b]pyridine-2-carboxylic acid

Systemtic Name: 6-(4-bromophenyl)-4-methyl-3-(1-morpholin-4-ylethylideneamino)thieno[2,3-b]pyridine-2-carboxylic acid Openeye Name: 6-(4-bromophenyl)-4-methyl-3-(1-morpholinoethylideneamino)thieno[2,3-b]pyridine-2-carboxylic acid CAS Name: 6-(4-bromophenyl)-4-methyl-3-[1-(4-morpholinyl)ethylideneamino]-2-thieno[2,3-b]pyridinecarboxylic acid IUPAC Name: 6-(4-bromophenyl)-4-methyl-3-(1-morpholin-4-ylethylideneamino)thieno[2,3-b]pyridine-2-carboxylic acid Traditional Name: 6-(4-bromophenyl)-4-methyl-3-(1-morpholinoethylideneamino)thieno[2,3-b]pyridine-2-carboxylic acid Formula: C21H20BrN3O3S MolecularWeight: 474.3708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=C(S2)C(=O)O)N=C(C)N3CCOCC3)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC(=NC2=C1C(=C(S2)C(=O)O)N=C(C)N3CCOCC3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H20BrN3O3S/c1-12-11-16(14-3-5-15(22)6-4-14)24-20-17(12)18(19(29-20)21(26)27)23-13(2)25-7-9-28-10-8-25/h3-6,11H,7-10H2,1-2H3,(H,26,27)