5-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]thiophene-2-carboxylic acid

Systemtic Name: 5-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]thiophene-2-carboxylic acid Openeye Name: 5-[[(E)-3-(3-pyridyl)prop-2-enoyl]amino]thiophene-2-carboxylic acid CAS Name: 5-[[(E)-1-oxo-3-(3-pyridinyl)prop-2-enyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]thiophene-2-carboxylic acid Traditional Name: 5-[[(E)-3-(3-pyridyl)acryloyl]amino]-2-thenoic acid Formula: C13H10N2O3S MolecularWeight: 274.2951

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C=CC(=O)NC2=CC=C(S2)C(=O)O

Isomeric SMILES

C1=CC(=CN=C1)/C=C/C(=O)NC2=CC=C(S2)C(=O)O

InChI

InChI=1S/C13H10N2O3S/c16-11(5-3-9-2-1-7-14-8-9)15-12-6-4-10(19-12)13(17)18/h1-8H,(H,15,16)(H,17,18)/b5-3+