N-[[4-(2-azanyl-2-oxidanylidene-ethyl)-2-fluoranyl-phenyl]methyl]-4-(3-cyanophenoxy)-1,3-thiazole-5-carboxamide

Systemtic Name: N-[[4-(2-azanyl-2-oxidanylidene-ethyl)-2-fluoranyl-phenyl]methyl]-4-(3-cyanophenoxy)-1,3-thiazole-5-carboxamide Openeye Name: N-[[4-(2-amino-2-oxo-ethyl)-2-fluoro-phenyl]methyl]-4-(3-cyanophenoxy)thiazole-5-carboxamide CAS Name: N-[[4-(2-amino-2-oxoethyl)-2-fluorophenyl]methyl]-4-(3-cyanophenoxy)-5-thiazolecarboxamide IUPAC Name: N-[[4-(2-amino-2-oxoethyl)-2-fluorophenyl]methyl]-4-(3-cyanophenoxy)-1,3-thiazole-5-carboxamide Traditional Name: N-[4-(2-amino-2-keto-ethyl)-2-fluoro-benzyl]-4-(3-cyanophenoxy)thiazole-5-carboxamide Formula: C20H15FN4O3S MolecularWeight: 410.421503

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=C(SC=N2)C(=O)NCC3=C(C=C(C=C3)CC(=O)N)F)C#N

Isomeric SMILES

C1=CC(=CC(=C1)OC2=C(SC=N2)C(=O)NCC3=C(C=C(C=C3)CC(=O)N)F)C#N

InChI

InChI=1S/C20H15FN4O3S/c21-16-7-12(8-17(23)26)4-5-14(16)10-24-19(27)18-20(25-11-29-18)28-15-3-1-2-13(6-15)9-22/h1-7,11H,8,10H2,(H2,23,26)(H,24,27)