3-azanyl-4-[methyl(2-pyridin-2-ylethyl)amino]thieno[2,3-b]pyridine-2-carboxylic acid

Systemtic Name: 3-azanyl-4-[methyl(2-pyridin-2-ylethyl)amino]thieno[2,3-b]pyridine-2-carboxylic acid Openeye Name: 3-amino-4-[methyl-[2-(2-pyridyl)ethyl]amino]thieno[2,3-b]pyridine-2-carboxylic acid CAS Name: 3-amino-4-[methyl-[2-(2-pyridinyl)ethyl]amino]-2-thieno[2,3-b]pyridinecarboxylic acid IUPAC Name: 3-amino-4-[methyl(2-pyridin-2-ylethyl)amino]thieno[2,3-b]pyridine-2-carboxylic acid Traditional Name: 3-amino-4-[methyl-[2-(2-pyridyl)ethyl]amino]thieno[2,3-b]pyridine-2-carboxylic acid Formula: C16H16N4O2S MolecularWeight: 328.38884

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=N1)C2=C3C(=C(SC3=NC=C2)C(=O)O)N

Isomeric SMILES

CN(CCC1=CC=CC=N1)C2=C3C(=C(SC3=NC=C2)C(=O)O)N

InChI

InChI=1S/C16H16N4O2S/c1-20(9-6-10-4-2-3-7-18-10)11-5-8-19-15-12(11)13(17)14(23-15)16(21)22/h2-5,7-8H,6,9,17H2,1H3,(H,21,22)