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

Systemtic Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-fluorophenyl)imino-N-(2-methoxyphenyl)-4-oxidanylidene-1,3-thiazinane-6-carboxamide Openeye Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-fluorophenyl)imino-N-(2-methoxyphenyl)-4-oxo-1,3-thiazinane-6-carboxamide CAS Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-fluorophenyl)imino-N-(2-methoxyphenyl)-4-oxo-1,3-thiazinane-6-carboxamide IUPAC Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-fluorophenyl)imino-N-(2-methoxyphenyl)-4-oxo-1,3-thiazinane-6-carboxamide Traditional Name: 2-(4-fluorophenyl)imino-3-homoveratryl-4-keto-N-(2-methoxyphenyl)-1,3-thiazinane-6-carboxamide Formula: C28H28FN3O5S MolecularWeight: 537.602423

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2C(=O)CC(SC2=NC3=CC=C(C=C3)F)C(=O)NC4=CC=CC=C4OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C(=O)CC(SC2=NC3=CC=C(C=C3)F)C(=O)NC4=CC=CC=C4OC)OC

InChI

InChI=1S/C28H28FN3O5S/c1-35-22-7-5-4-6-21(22)31-27(34)25-17-26(33)32(28(38-25)30-20-11-9-19(29)10-12-20)15-14-18-8-13-23(36-2)24(16-18)37-3/h4-13,16,25H,14-15,17H2,1-3H3,(H,31,34)