2-[2-[[5-ethyl-3-(4-fluorophenyl)carbonyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl]sulfanyl-2-methyl-propanoic acid

Systemtic Name: 2-[2-[[5-ethyl-3-(4-fluorophenyl)carbonyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl]sulfanyl-2-methyl-propanoic acid Openeye Name: 2-[2-[[5-ethyl-3-(4-fluorobenzoyl)-2-thienyl]amino]-2-oxo-ethyl]sulfanyl-2-methyl-propanoic acid CAS Name: 2-[[2-[[5-ethyl-3-[(4-fluorophenyl)-oxomethyl]-2-thiophenyl]amino]-2-oxoethyl]thio]-2-methylpropanoic acid IUPAC Name: 2-[2-[[5-ethyl-3-(4-fluorobenzoyl)thiophen-2-yl]amino]-2-oxoethyl]sulfanyl-2-methylpropanoic acid Traditional Name: 2-[[2-[[5-ethyl-3-(4-fluorobenzoyl)-2-thienyl]amino]-2-keto-ethyl]thio]-2-methyl-propionic acid Formula: C19H20FNO4S2 MolecularWeight: 409.494803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CSC(C)(C)C(=O)O)C(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CSC(C)(C)C(=O)O)C(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C19H20FNO4S2/c1-4-13-9-14(16(23)11-5-7-12(20)8-6-11)17(27-13)21-15(22)10-26-19(2,3)18(24)25/h5-9H,4,10H2,1-3H3,(H,21,22)(H,24,25)