2-[4-[4-[2-(acetamidomethyl)-5-oxidanylidene-1,2-oxazol-4-yl]-2-fluoranyl-phenyl]piperazin-1-yl]-N-(1,3,4-thiadiazol-2-yl)ethanamide

Systemtic Name: 2-[4-[4-[2-(acetamidomethyl)-5-oxidanylidene-1,2-oxazol-4-yl]-2-fluoranyl-phenyl]piperazin-1-yl]-N-(1,3,4-thiadiazol-2-yl)ethanamide Openeye Name: 2-[4-[4-[2-(acetamidomethyl)-5-oxo-isoxazol-4-yl]-2-fluoro-phenyl]piperazin-1-yl]-N-(1,3,4-thiadiazol-2-yl)acetamide CAS Name: 2-[4-[4-[2-(acetamidomethyl)-5-oxo-4-isoxazolyl]-2-fluorophenyl]-1-piperazinyl]-N-(1,3,4-thiadiazol-2-yl)acetamide IUPAC Name: 2-[4-[4-[2-(acetamidomethyl)-5-oxo-1,2-oxazol-4-yl]-2-fluorophenyl]piperazin-1-yl]-N-(1,3,4-thiadiazol-2-yl)acetamide Traditional Name: 2-[4-[4-[2-(acetamidomethyl)-5-keto-3-isoxazolin-4-yl]-2-fluoro-phenyl]piperazino]-N-(1,3,4-thiadiazol-2-yl)acetamide Formula: C20H22FN7O4S MolecularWeight: 475.496583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCN1C=C(C(=O)O1)C2=CC(=C(C=C2)N3CCN(CC3)CC(=O)NC4=NN=CS4)F

Isomeric SMILES

CC(=O)NCN1C=C(C(=O)O1)C2=CC(=C(C=C2)N3CCN(CC3)CC(=O)NC4=NN=CS4)F

InChI

InChI=1S/C20H22FN7O4S/c1-13(29)22-11-28-9-15(19(31)32-28)14-2-3-17(16(21)8-14)27-6-4-26(5-7-27)10-18(30)24-20-25-23-12-33-20/h2-3,8-9,12H,4-7,10-11H2,1H3,(H,22,29)(H,24,25,30)