N-[2-[[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]amino]-2-oxidanylidene-ethyl]-2-fluoranyl-benzamide

Systemtic Name: N-[2-[[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]amino]-2-oxidanylidene-ethyl]-2-fluoranyl-benzamide Openeye Name: N-[2-[[4-(4-tert-butylphenyl)thiazol-2-yl]amino]-2-oxo-ethyl]-2-fluoro-benzamide CAS Name: N-[2-[[4-(4-tert-butylphenyl)-2-thiazolyl]amino]-2-oxoethyl]-2-fluorobenzamide IUPAC Name: N-[2-[[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]-2-fluorobenzamide Traditional Name: N-[2-[[4-(4-tert-butylphenyl)thiazol-2-yl]amino]-2-keto-ethyl]-2-fluoro-benzamide Formula: C22H22FN3O2S MolecularWeight: 411.492383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CNC(=O)C3=CC=CC=C3F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CNC(=O)C3=CC=CC=C3F

InChI

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