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

Systemtic Name: 3-azanyl-6-(4-methylpiperazin-1-yl)-4-propyl-thieno[2,3-b]pyridine-2-carboxylic acid Openeye Name: 3-amino-6-(4-methylpiperazin-1-yl)-4-propyl-thieno[2,3-b]pyridine-2-carboxylic acid CAS Name: 3-amino-6-(4-methyl-1-piperazinyl)-4-propyl-2-thieno[2,3-b]pyridinecarboxylic acid IUPAC Name: 3-amino-6-(4-methylpiperazin-1-yl)-4-propylthieno[2,3-b]pyridine-2-carboxylic acid Traditional Name: 3-amino-6-(4-methylpiperazino)-4-propyl-thieno[2,3-b]pyridine-2-carboxylic acid Formula: C16H22N4O2S MolecularWeight: 334.43648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=NC2=C1C(=C(S2)C(=O)O)N)N3CCN(CC3)C

Isomeric SMILES

CCCC1=CC(=NC2=C1C(=C(S2)C(=O)O)N)N3CCN(CC3)C

InChI

InChI=1S/C16H22N4O2S/c1-3-4-10-9-11(20-7-5-19(2)6-8-20)18-15-12(10)13(17)14(23-15)16(21)22/h9H,3-8,17H2,1-2H3,(H,21,22)