N-[4-(4-acetamido-2-fluoranyl-phenyl)-1,3-thiazol-2-yl]-3-(2-phenylethanoylamino)propanamide

Systemtic Name: N-[4-(4-acetamido-2-fluoranyl-phenyl)-1,3-thiazol-2-yl]-3-(2-phenylethanoylamino)propanamide Openeye Name: N-[4-(4-acetamido-2-fluoro-phenyl)thiazol-2-yl]-3-[(2-phenylacetyl)amino]propanamide CAS Name: N-[4-(4-acetamido-2-fluorophenyl)-2-thiazolyl]-3-[(1-oxo-2-phenylethyl)amino]propanamide IUPAC Name: N-[4-(4-acetamido-2-fluorophenyl)-1,3-thiazol-2-yl]-3-[(2-phenylacetyl)amino]propanamide Traditional Name: N-[4-(4-acetamido-2-fluoro-phenyl)thiazol-2-yl]-3-[(2-phenylacetyl)amino]propionamide Formula: C22H21FN4O3S MolecularWeight: 440.490543

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)CCNC(=O)CC3=CC=CC=C3)F

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)CCNC(=O)CC3=CC=CC=C3)F

InChI

InChI=1S/C22H21FN4O3S/c1-14(28)25-16-7-8-17(18(23)12-16)19-13-31-22(26-19)27-20(29)9-10-24-21(30)11-15-5-3-2-4-6-15/h2-8,12-13H,9-11H2,1H3,(H,24,30)(H,25,28)(H,26,27,29)