3-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-fluorophenyl)-4-oxidanylidene-2-[3-(trifluoromethyl)phenyl]imino-1,3-thiazinane-6-carboxamide

Systemtic Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-fluorophenyl)-4-oxidanylidene-2-[3-(trifluoromethyl)phenyl]imino-1,3-thiazinane-6-carboxamide Openeye Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-fluorophenyl)-4-oxo-2-[3-(trifluoromethyl)phenyl]imino-1,3-thiazinane-6-carboxamide CAS Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-fluorophenyl)-4-oxo-2-[3-(trifluoromethyl)phenyl]imino-1,3-thiazinane-6-carboxamide IUPAC Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-fluorophenyl)-4-oxo-2-[3-(trifluoromethyl)phenyl]imino-1,3-thiazinane-6-carboxamide Traditional Name: N-(4-fluorophenyl)-3-homoveratryl-4-keto-2-[3-(trifluoromethyl)phenyl]imino-1,3-thiazinane-6-carboxamide Formula: C28H25F4N3O4S MolecularWeight: 575.574413

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2C(=O)CC(SC2=NC3=CC=CC(=C3)C(F)(F)F)C(=O)NC4=CC=C(C=C4)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C(=O)CC(SC2=NC3=CC=CC(=C3)C(F)(F)F)C(=O)NC4=CC=C(C=C4)F)OC

InChI

InChI=1S/C28H25F4N3O4S/c1-38-22-11-6-17(14-23(22)39-2)12-13-35-25(36)16-24(26(37)33-20-9-7-19(29)8-10-20)40-27(35)34-21-5-3-4-18(15-21)28(30,31)32/h3-11,14-15,24H,12-13,16H2,1-2H3,(H,33,37)