3-azanyl-6-[2-(hydroxymethyl)piperidin-1-yl]-4-propyl-thieno[2,3-b]pyridine-2-carboxylic acid

Systemtic Name: 3-azanyl-6-[2-(hydroxymethyl)piperidin-1-yl]-4-propyl-thieno[2,3-b]pyridine-2-carboxylic acid Openeye Name: 3-amino-6-[2-(hydroxymethyl)-1-piperidyl]-4-propyl-thieno[2,3-b]pyridine-2-carboxylic acid CAS Name: 3-amino-6-[2-(hydroxymethyl)-1-piperidinyl]-4-propyl-2-thieno[2,3-b]pyridinecarboxylic acid IUPAC Name: 3-amino-6-[2-(hydroxymethyl)piperidin-1-yl]-4-propylthieno[2,3-b]pyridine-2-carboxylic acid Traditional Name: 3-amino-6-(2-methylolpiperidino)-4-propyl-thieno[2,3-b]pyridine-2-carboxylic acid Formula: C17H23N3O3S MolecularWeight: 349.44782

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=NC2=C1C(=C(S2)C(=O)O)N)N3CCCCC3CO

Isomeric SMILES

CCCC1=CC(=NC2=C1C(=C(S2)C(=O)O)N)N3CCCCC3CO

InChI

InChI=1S/C17H23N3O3S/c1-2-5-10-8-12(20-7-4-3-6-11(20)9-21)19-16-13(10)14(18)15(24-16)17(22)23/h8,11,21H,2-7,9,18H2,1H3,(H,22,23)