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3-Methyl-2-[methylthio(2,3-bis(methoxycarbonyl)propylimino)methylimino]-2,3-dihydrobenzothiazole
SpectraBase Compound ID 3t1QCZ0J5iW
InChI InChI=1S/C17H21N3O4S2/c1-20-12-7-5-6-8-13(12)26-17(20)19-16(25-4)18-10-11(15(22)24-3)9-14(21)23-2/h5-8,11H,9-10H2,1-4H3/b18-16+,19-17+
InChIKey DKFCIMDUKSQDNQ-YWNVXTCZSA-N
Mol Weight 395.49 g/mol
Molecular Formula C17H21N3O4S2
Exact Mass 395.097349 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BcxvDoRLeyJ
Name 3-Methyl-2-[methylthio(2,3-bis(methoxycarbonyl)propylimino)methylimino]-2,3-dihydrobenzothiazole
Alternate Name(s) Dimethyl 2-({[(E)-[((2E)-3-methyl-1,3-benzothiazol-2(3H)-ylidene)amino](methylsulfanyl)methylidene]amino}methyl)succinate
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Formula C17H21N3O4S2
InChI InChI=1S/C17H21N3O4S2/c1-20-12-7-5-6-8-13(12)26-17(20)19-16(25-4)18-10-11(15(22)24-3)9-14(21)23-2/h5-8,11H,9-10H2,1-4H3/b18-16+,19-17+
InChIKey DKFCIMDUKSQDNQ-YWNVXTCZSA-N
Molecular Weight 395.492 g/mol
SMILES c12N(\C(Sc1cccc2)=N/C(=N\CC(C(=O)OC)CC(=O)OC)SC)C
SPLASH splash10-0udi-0090000000-faea85d9c8b8385f2729
Source of Spectrum E1-43-206-16
Wiley ID 1552954