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

Systemtic Name: 4,6-bis(4-bromophenyl)-3-(1-piperidin-1-ylethylideneamino)thieno[2,3-b]pyridine-2-carboxylic acid Openeye Name: 4,6-bis(4-bromophenyl)-3-[1-(1-piperidyl)ethylideneamino]thieno[2,3-b]pyridine-2-carboxylic acid CAS Name: 4,6-bis(4-bromophenyl)-3-[1-(1-piperidinyl)ethylideneamino]-2-thieno[2,3-b]pyridinecarboxylic acid IUPAC Name: 4,6-bis(4-bromophenyl)-3-(1-piperidin-1-ylethylideneamino)thieno[2,3-b]pyridine-2-carboxylic acid Traditional Name: 4,6-bis(4-bromophenyl)-3-(1-piperidinoethylideneamino)thieno[2,3-b]pyridine-2-carboxylic acid Formula: C27H23Br2N3O2S MolecularWeight: 613.36342

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC1=C(SC2=C1C(=CC(=N2)C3=CC=C(C=C3)Br)C4=CC=C(C=C4)Br)C(=O)O)N5CCCCC5

Isomeric SMILES

CC(=NC1=C(SC2=C1C(=CC(=N2)C3=CC=C(C=C3)Br)C4=CC=C(C=C4)Br)C(=O)O)N5CCCCC5

InChI

InChI=1S/C27H23Br2N3O2S/c1-16(32-13-3-2-4-14-32)30-24-23-21(17-5-9-19(28)10-6-17)15-22(18-7-11-20(29)12-8-18)31-26(23)35-25(24)27(33)34/h5-12,15H,2-4,13-14H2,1H3,(H,33,34)