3-azanyl-4-[4-(furan-2-ylcarbonyl)piperazin-1-yl]thieno[2,3-b]pyridine-2-carboxylic acid

Systemtic Name: 3-azanyl-4-[4-(furan-2-ylcarbonyl)piperazin-1-yl]thieno[2,3-b]pyridine-2-carboxylic acid Openeye Name: 3-amino-4-[4-(furan-2-carbonyl)piperazin-1-yl]thieno[2,3-b]pyridine-2-carboxylic acid CAS Name: 3-amino-4-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-2-thieno[2,3-b]pyridinecarboxylic acid IUPAC Name: 3-amino-4-[4-(furan-2-carbonyl)piperazin-1-yl]thieno[2,3-b]pyridine-2-carboxylic acid Traditional Name: 3-amino-4-[4-(2-furoyl)piperazino]thieno[2,3-b]pyridine-2-carboxylic acid Formula: C17H16N4O4S MolecularWeight: 372.39834

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C3C(=C(SC3=NC=C2)C(=O)O)N)C(=O)C4=CC=CO4

Isomeric SMILES

C1CN(CCN1C2=C3C(=C(SC3=NC=C2)C(=O)O)N)C(=O)C4=CC=CO4

InChI

InChI=1S/C17H16N4O4S/c18-13-12-10(3-4-19-15(12)26-14(13)17(23)24)20-5-7-21(8-6-20)16(22)11-2-1-9-25-11/h1-4,9H,5-8,18H2,(H,23,24)