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

Systemtic Name: 6-[3-(aminomethyl)piperidin-1-yl]-3-azanyl-4-propyl-thieno[2,3-b]pyridine-2-carboxylic acid Openeye Name: 3-amino-6-[3-(aminomethyl)-1-piperidyl]-4-propyl-thieno[2,3-b]pyridine-2-carboxylic acid CAS Name: 3-amino-6-[3-(aminomethyl)-1-piperidinyl]-4-propyl-2-thieno[2,3-b]pyridinecarboxylic acid IUPAC Name: 3-amino-6-[3-(aminomethyl)piperidin-1-yl]-4-propylthieno[2,3-b]pyridine-2-carboxylic acid Traditional Name: 3-amino-6-[3-(aminomethyl)piperidino]-4-propyl-thieno[2,3-b]pyridine-2-carboxylic acid Formula: C17H24N4O2S MolecularWeight: 348.46306

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=NC2=C1C(=C(S2)C(=O)O)N)N3CCCC(C3)CN

Isomeric SMILES

CCCC1=CC(=NC2=C1C(=C(S2)C(=O)O)N)N3CCCC(C3)CN

InChI

InChI=1S/C17H24N4O2S/c1-2-4-11-7-12(21-6-3-5-10(8-18)9-21)20-16-13(11)14(19)15(24-16)17(22)23/h7,10H,2-6,8-9,18-19H2,1H3,(H,22,23)