5-[[3-cyano-4-(furan-3-yl)-6-thiophen-2-yl-pyridin-2-yl]oxymethyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[[3-cyano-4-(furan-3-yl)-6-thiophen-2-yl-pyridin-2-yl]oxymethyl]thiophene-2-carboxylic acid Openeye Name: 5-[[3-cyano-4-(3-furyl)-6-(2-thienyl)-2-pyridyl]oxymethyl]thiophene-2-carboxylic acid CAS Name: 5-[[3-cyano-4-(3-furanyl)-6-thiophen-2-yl-2-pyridinyl]oxymethyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[[3-cyano-4-(furan-3-yl)-6-thiophen-2-ylpyridin-2-yl]oxymethyl]thiophene-2-carboxylic acid Traditional Name: 5-[[3-cyano-4-(3-furyl)-6-(2-thienyl)-2-pyridyl]oxymethyl]-2-thenoic acid Formula: C20H12N2O4S2 MolecularWeight: 408.45028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NC(=C(C(=C2)C3=COC=C3)C#N)OCC4=CC=C(S4)C(=O)O

Isomeric SMILES

C1=CSC(=C1)C2=NC(=C(C(=C2)C3=COC=C3)C#N)OCC4=CC=C(S4)C(=O)O

InChI

InChI=1S/C20H12N2O4S2/c21-9-15-14(12-5-6-25-10-12)8-16(17-2-1-7-27-17)22-19(15)26-11-13-3-4-18(28-13)20(23)24/h1-8,10H,11H2,(H,23,24)