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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=C1)C3=CC=CC=C3)C(=C(S2)C(=O)O)N=CN4CCCCC4

Isomeric SMILES

CC1=NC2=C(C(=C1)C3=CC=CC=C3)C(=C(S2)C(=O)O)N=CN4CCCCC4

InChI

InChI=1S/C21H21N3O2S/c1-14-12-16(15-8-4-2-5-9-15)17-18(19(21(25)26)27-20(17)23-14)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)