5-[[5-[(2-ethoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]furan-2-carboxylic acid

Systemtic Name: 5-[[5-[(2-ethoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]furan-2-carboxylic acid Openeye Name: 5-[[5-(2-ethoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]furan-2-carboxylic acid CAS Name: 5-[[[5-(2-ethoxyanilino)-1,3,4-thiadiazol-2-yl]thio]methyl]-2-furancarboxylic acid IUPAC Name: 5-[[5-(2-ethoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]furan-2-carboxylic acid Traditional Name: 5-[[[5-(o-phenetidino)-1,3,4-thiadiazol-2-yl]thio]methyl]-2-furoic acid Formula: C16H15N3O4S2 MolecularWeight: 377.438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC2=NN=C(S2)SCC3=CC=C(O3)C(=O)O

Isomeric SMILES

CCOC1=CC=CC=C1NC2=NN=C(S2)SCC3=CC=C(O3)C(=O)O

InChI

InChI=1S/C16H15N3O4S2/c1-2-22-12-6-4-3-5-11(12)17-15-18-19-16(25-15)24-9-10-7-8-13(23-10)14(20)21/h3-8H,2,9H2,1H3,(H,17,18)(H,20,21)