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5-(Ethoxycarbonyl)-N-(benzoxycarbonylamino)-2-(phenylimino)-4-methyl-2,3-dihydrothiazole
SpectraBase Compound ID LgwLJyBXZXb
InChI InChI=1S/C21H21N3O4S/c1-3-27-19(25)18-15(2)24(20(29-18)22-17-12-8-5-9-13-17)23-21(26)28-14-16-10-6-4-7-11-16/h4-13H,3,14H2,1-2H3,(H,23,26)/b22-20+
InChIKey KBGZHJCJDJEULP-LSDHQDQOSA-N
Mol Weight 411.48 g/mol
Molecular Formula C21H21N3O4S
Exact Mass 411.125277 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ykX3EU1fYt
Name 5-(Ethoxycarbonyl)-N-(benzoxycarbonylamino)-2-(phenylimino)-4-methyl-2,3-dihydrothiazole
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Formula C21H21N3O4S
InChI InChI=1S/C21H21N3O4S/c1-3-27-19(25)18-15(2)24(20(29-18)22-17-12-8-5-9-13-17)23-21(26)28-14-16-10-6-4-7-11-16/h4-13H,3,14H2,1-2H3,(H,23,26)/b22-20+
InChIKey KBGZHJCJDJEULP-LSDHQDQOSA-N
Molecular Weight 411.476 g/mol
SMILES N(N1C(=C(S\C1=N/c1ccccc1)C(=O)OCC)C)C(=O)OCc1ccccc1
SPLASH splash10-000i-0900100000-c0228d8e3c7cff9a0be8
Source of Spectrum F-55-13432-6
Synonyms Ethyl (2E)-3-{[(benzyloxy)carbonyl]amino}-4-methyl-2-(phenylimino)-2,3-dihydro-1,3-thiazole-5-carboxylate
Wiley ID 839828