3-azanyl-6-[4-[(2-oxidanyl-2-pyridin-2-yl-ethyl)amino]piperidin-1-yl]-4-propan-2-yl-thieno[2,3-b]pyridine-2-carboxylic acid

Systemtic Name: 3-azanyl-6-[4-[(2-oxidanyl-2-pyridin-2-yl-ethyl)amino]piperidin-1-yl]-4-propan-2-yl-thieno[2,3-b]pyridine-2-carboxylic acid Openeye Name: 3-amino-6-[4-[[2-hydroxy-2-(2-pyridyl)ethyl]amino]-1-piperidyl]-4-isopropyl-thieno[2,3-b]pyridine-2-carboxylic acid CAS Name: 3-amino-6-[4-[[2-hydroxy-2-(2-pyridinyl)ethyl]amino]-1-piperidinyl]-4-propan-2-yl-2-thieno[2,3-b]pyridinecarboxylic acid IUPAC Name: 3-amino-6-[4-[(2-hydroxy-2-pyridin-2-ylethyl)amino]piperidin-1-yl]-4-propan-2-ylthieno[2,3-b]pyridine-2-carboxylic acid Traditional Name: 3-amino-6-[4-[[2-hydroxy-2-(2-pyridyl)ethyl]amino]piperidino]-4-isopropyl-thieno[2,3-b]pyridine-2-carboxylic acid Formula: C23H29N5O3S MolecularWeight: 455.57306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=NC2=C1C(=C(S2)C(=O)O)N)N3CCC(CC3)NCC(C4=CC=CC=N4)O

Isomeric SMILES

CC(C)C1=CC(=NC2=C1C(=C(S2)C(=O)O)N)N3CCC(CC3)NCC(C4=CC=CC=N4)O

InChI

InChI=1S/C23H29N5O3S/c1-13(2)15-11-18(27-22-19(15)20(24)21(32-22)23(30)31)28-9-6-14(7-10-28)26-12-17(29)16-5-3-4-8-25-16/h3-5,8,11,13-14,17,26,29H,6-7,9-10,12,24H2,1-2H3,(H,30,31)