N-[5-tert-butyl-3-[(1-methylsulfonylazetidin-3-yl)methyl]-1,3-thiazol-2-ylidene]-2-methoxy-5-(trifluoromethyl)benzamide

Systemtic Name: N-[5-tert-butyl-3-[(1-methylsulfonylazetidin-3-yl)methyl]-1,3-thiazol-2-ylidene]-2-methoxy-5-(trifluoromethyl)benzamide Openeye Name: N-[5-tert-butyl-3-[(1-methylsulfonylazetidin-3-yl)methyl]thiazol-2-ylidene]-2-methoxy-5-(trifluoromethyl)benzamide CAS Name: N-[5-tert-butyl-3-[(1-methylsulfonyl-3-azetidinyl)methyl]-2-thiazolylidene]-2-methoxy-5-(trifluoromethyl)benzamide IUPAC Name: N-[5-tert-butyl-3-[(1-methylsulfonylazetidin-3-yl)methyl]-1,3-thiazol-2-ylidene]-2-methoxy-5-(trifluoromethyl)benzamide Traditional Name: N-[5-tert-butyl-3-[(1-mesylazetidin-3-yl)methyl]-4-thiazolin-2-ylidene]-2-methoxy-5-(trifluoromethyl)benzamide Formula: C21H26F3N3O4S2 MolecularWeight: 505.57405

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CN(C(=NC(=O)C2=C(C=CC(=C2)C(F)(F)F)OC)S1)CC3CN(C3)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)C1=CN(C(=NC(=O)C2=C(C=CC(=C2)C(F)(F)F)OC)S1)CC3CN(C3)S(=O)(=O)C

InChI

InChI=1S/C21H26F3N3O4S2/c1-20(2,3)17-12-26(9-13-10-27(11-13)33(5,29)30)19(32-17)25-18(28)15-8-14(21(22,23)24)6-7-16(15)31-4/h6-8,12-13H,9-11H2,1-5H3