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2H-1,3-thiazine-6-carboxamide, 2-[(4-chlorophenyl)imino]tetrahydro-N-(4-methoxyphenyl)-4-oxo-3-(2-tricyclo[3.3.1.1~3,7~]dec-1-ylethyl)-, (2E)-
SpectraBase Compound ID 6Me5K0oVZ0d
InChI InChI=1S/C30H34ClN3O3S/c1-37-25-8-6-23(7-9-25)32-28(36)26-15-27(35)34(29(38-26)33-24-4-2-22(31)3-5-24)11-10-30-16-19-12-20(17-30)14-21(13-19)18-30/h2-9,19-21,26H,10-18H2,1H3,(H,32,36)/b33-29+/t19-,20+,21-,26?,30+
InChIKey JQJWAAHKJWBUKI-AXBOZJKWSA-N
Mol Weight 552.1 g/mol
Molecular Formula C30H34ClN3O3S
Exact Mass 551.200941 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8YYhFUVo6Sf
Name 3-(2-Adamantan-1-yl-ethyl)-2-(4-chloro-phenylimino)-4-oxo-[1,3]thiazinane-6-carboxylic acid (4-methoxy-phenyl)-amide
Alternate Name(s) (2E)-3-[2-(1-adamantyl)ethyl]-2-[(4-chlorophenyl)imino]-N-(4-methoxyphenyl)-4-oxotetrahydro-2H-1,3-thiazine-6-carboxamide 3-[2-(1-adamantyl)ethyl]-2-[(4-chlorophenyl)imino]-N-(4-methoxyphenyl)-4-oxo-1,3-thiazinane-6-carboxamide
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Formula C30H34ClN3O3S
InChI InChI=1S/C30H34ClN3O3S/c1-37-25-8-6-23(7-9-25)32-28(36)26-15-27(35)34(29(38-26)33-24-4-2-22(31)3-5-24)11-10-30-16-19-12-20(17-30)14-21(13-19)18-30/h2-9,19-21,26H,10-18H2,1H3,(H,32,36)/b33-29+/t19-,20+,21-,26?,30+
InChIKey JQJWAAHKJWBUKI-AXBOZJKWSA-N
Molecular Weight 552.133 g/mol
SMILES N(C(C1CC(N(\C(S1)=N/c1ccc(cc1)Cl)CCC12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])=O)=O)c1ccc(cc1)OC
SPLASH splash10-000f-9610000000-879aa72c829baf5aa263
Wiley ID 1464919