2-acetamido-N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-acetamido-N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-acetamido-N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]thiazole-4-carboxamide CAS Name: 2-acetamido-N-[[3-(4-fluorophenyl)-1-phenyl-4-pyrazolyl]methyl]-4-thiazolecarboxamide IUPAC Name: 2-acetamido-N-[[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-acetamido-N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]thiazole-4-carboxamide Formula: C22H18FN5O2S MolecularWeight: 435.474023

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)C(=O)NCC2=CN(N=C2C3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1=NC(=CS1)C(=O)NCC2=CN(N=C2C3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C22H18FN5O2S/c1-14(29)25-22-26-19(13-31-22)21(30)24-11-16-12-28(18-5-3-2-4-6-18)27-20(16)15-7-9-17(23)10-8-15/h2-10,12-13H,11H2,1H3,(H,24,30)(H,25,26,29)