N-[5-[2-(4-ethoxyphenyl)sulfanylethanoylamino]-2-fluoranyl-phenyl]-2-methyl-furan-3-carboxamide

Systemtic Name: N-[5-[2-(4-ethoxyphenyl)sulfanylethanoylamino]-2-fluoranyl-phenyl]-2-methyl-furan-3-carboxamide Openeye Name: N-[5-[[2-(4-ethoxyphenyl)sulfanylacetyl]amino]-2-fluoro-phenyl]-2-methyl-furan-3-carboxamide CAS Name: N-[5-[[2-[(4-ethoxyphenyl)thio]-1-oxoethyl]amino]-2-fluorophenyl]-2-methyl-3-furancarboxamide IUPAC Name: N-[5-[[2-(4-ethoxyphenyl)sulfanylacetyl]amino]-2-fluorophenyl]-2-methylfuran-3-carboxamide Traditional Name: N-[2-fluoro-5-[[2-(p-phenetylthio)acetyl]amino]phenyl]-2-methyl-3-furamide Formula: C22H21FN2O4S MolecularWeight: 428.476543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)SCC(=O)NC2=CC(=C(C=C2)F)NC(=O)C3=C(OC=C3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)SCC(=O)NC2=CC(=C(C=C2)F)NC(=O)C3=C(OC=C3)C

InChI

InChI=1S/C22H21FN2O4S/c1-3-28-16-5-7-17(8-6-16)30-13-21(26)24-15-4-9-19(23)20(12-15)25-22(27)18-10-11-29-14(18)2/h4-12H,3,13H2,1-2H3,(H,24,26)(H,25,27)