N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-(2-phenylsulfanylethanoylamino)pentanamide

Systemtic Name: N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-(2-phenylsulfanylethanoylamino)pentanamide Openeye Name: N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-[(2-phenylsulfanylacetyl)amino]pentanamide CAS Name: N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-[[1-oxo-2-(phenylthio)ethyl]amino]pentanamide IUPAC Name: N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-[(2-phenylsulfanylacetyl)amino]pentanamide Traditional Name: N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-[[2-(phenylthio)acetyl]amino]valeramide Formula: C22H23FN4O2S2 MolecularWeight: 458.572023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC=C(C=C2)F)NC(=O)CSC3=CC=CC=C3

Isomeric SMILES

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC=C(C=C2)F)NC(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C22H23FN4O2S2/c1-3-14(2)19(24-18(28)13-30-17-7-5-4-6-8-17)20(29)25-22-27-26-21(31-22)15-9-11-16(23)12-10-15/h4-12,14,19H,3,13H2,1-2H3,(H,24,28)(H,25,27,29)