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

Systemtic Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-fluorophenyl)imino-4-oxidanylidene-N-phenethyl-1,3-thiazinane-6-carboxamide Openeye Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-fluorophenyl)imino-4-oxo-N-phenethyl-1,3-thiazinane-6-carboxamide CAS Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-fluorophenyl)imino-4-oxo-N-phenethyl-1,3-thiazinane-6-carboxamide IUPAC Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-fluorophenyl)imino-4-oxo-N-phenethyl-1,3-thiazinane-6-carboxamide Traditional Name: 2-(4-fluorophenyl)imino-3-homoveratryl-4-keto-N-phenethyl-1,3-thiazinane-6-carboxamide Formula: C29H30FN3O4S MolecularWeight: 535.629603

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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)NCCC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C(=O)CC(SC2=NC3=CC=C(C=C3)F)C(=O)NCCC4=CC=CC=C4)OC

InChI

InChI=1S/C29H30FN3O4S/c1-36-24-13-8-21(18-25(24)37-2)15-17-33-27(34)19-26(28(35)31-16-14-20-6-4-3-5-7-20)38-29(33)32-23-11-9-22(30)10-12-23/h3-13,18,26H,14-17,19H2,1-2H3,(H,31,35)