2-(4-fluorophenyl)-4-methyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-1,3-thiazole-5-carboxamide

Systemtic Name: 2-(4-fluorophenyl)-4-methyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-1,3-thiazole-5-carboxamide Openeye Name: 2-(4-fluorophenyl)-4-methyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]thiazole-5-carboxamide CAS Name: 2-(4-fluorophenyl)-4-methyl-N-[[3-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]-5-thiazolecarboxamide IUPAC Name: 2-(4-fluorophenyl)-4-methyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-1,3-thiazole-5-carboxamide Traditional Name: 2-(4-fluorophenyl)-N-[3-(isobutyrylamino)benzyl]-4-methyl-thiazole-5-carboxamide Formula: C22H22FN3O2S MolecularWeight: 411.492383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=C(C=C2)F)C(=O)NCC3=CC(=CC=C3)NC(=O)C(C)C

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=C(C=C2)F)C(=O)NCC3=CC(=CC=C3)NC(=O)C(C)C

InChI

InChI=1S/C22H22FN3O2S/c1-13(2)20(27)26-18-6-4-5-15(11-18)12-24-21(28)19-14(3)25-22(29-19)16-7-9-17(23)10-8-16/h4-11,13H,12H2,1-3H3,(H,24,28)(H,26,27)