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

Systemtic Name: 4-methyl-6-phenyl-3-(piperidin-1-ylmethylideneamino)thieno[2,3-b]pyridine-2-carboxylic acid Openeye Name: 4-methyl-6-phenyl-3-(1-piperidylmethyleneamino)thieno[2,3-b]pyridine-2-carboxylic acid CAS Name: 4-methyl-6-phenyl-3-(1-piperidinylmethylideneamino)-2-thieno[2,3-b]pyridinecarboxylic acid IUPAC Name: 4-methyl-6-phenyl-3-(piperidin-1-ylmethylideneamino)thieno[2,3-b]pyridine-2-carboxylic acid Traditional Name: 4-methyl-6-phenyl-3-(piperidinomethyleneamino)thieno[2,3-b]pyridine-2-carboxylic acid Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=C(S2)C(=O)O)N=CN3CCCCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NC2=C1C(=C(S2)C(=O)O)N=CN3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C21H21N3O2S/c1-14-12-16(15-8-4-2-5-9-15)23-20-17(14)18(19(27-20)21(25)26)22-13-24-10-6-3-7-11-24/h2,4-5,8-9,12-13H,3,6-7,10-11H2,1H3,(H,25,26)