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

Systemtic Name: 4-(4-bromophenyl)-6-methyl-3-(1-piperidin-1-ylethylideneamino)thieno[2,3-b]pyridine-2-carboxylic acid Openeye Name: 4-(4-bromophenyl)-6-methyl-3-[1-(1-piperidyl)ethylideneamino]thieno[2,3-b]pyridine-2-carboxylic acid CAS Name: 4-(4-bromophenyl)-6-methyl-3-[1-(1-piperidinyl)ethylideneamino]-2-thieno[2,3-b]pyridinecarboxylic acid IUPAC Name: 4-(4-bromophenyl)-6-methyl-3-(1-piperidin-1-ylethylideneamino)thieno[2,3-b]pyridine-2-carboxylic acid Traditional Name: 4-(4-bromophenyl)-6-methyl-3-(1-piperidinoethylideneamino)thieno[2,3-b]pyridine-2-carboxylic acid Formula: C22H22BrN3O2S MolecularWeight: 472.39798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=C1)C3=CC=C(C=C3)Br)C(=C(S2)C(=O)O)N=C(C)N4CCCCC4

Isomeric SMILES

CC1=NC2=C(C(=C1)C3=CC=C(C=C3)Br)C(=C(S2)C(=O)O)N=C(C)N4CCCCC4

InChI

InChI=1S/C22H22BrN3O2S/c1-13-12-17(15-6-8-16(23)9-7-15)18-19(20(22(27)28)29-21(18)24-13)25-14(2)26-10-4-3-5-11-26/h6-9,12H,3-5,10-11H2,1-2H3,(H,27,28)