1-[(4-thieno[2,3-b]pyridin-3-ylpiperazin-1-yl)methyl]cyclopropane-1-carboxylic acid

Systemtic Name: 1-[(4-thieno[2,3-b]pyridin-3-ylpiperazin-1-yl)methyl]cyclopropane-1-carboxylic acid Openeye Name: 1-[(4-thieno[2,3-b]pyridin-3-ylpiperazin-1-yl)methyl]cyclopropanecarboxylic acid CAS Name: 1-[[4-(3-thieno[2,3-b]pyridinyl)-1-piperazinyl]methyl]-1-cyclopropanecarboxylic acid IUPAC Name: 1-[(4-thieno[2,3-b]pyridin-3-ylpiperazin-1-yl)methyl]cyclopropane-1-carboxylic acid Traditional Name: 1-[(4-thieno[2,3-b]pyridin-3-ylpiperazino)methyl]cyclopropanecarboxylic acid Formula: C16H19N3O2S MolecularWeight: 317.40596

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(CN2CCN(CC2)C3=CSC4=C3C=CC=N4)C(=O)O

Isomeric SMILES

C1CC1(CN2CCN(CC2)C3=CSC4=C3C=CC=N4)C(=O)O

InChI

InChI=1S/C16H19N3O2S/c20-15(21)16(3-4-16)11-18-6-8-19(9-7-18)13-10-22-14-12(13)2-1-5-17-14/h1-2,5,10H,3-4,6-9,11H2,(H,20,21)