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4-ETHOXYCARBONYL-5-PHENYL-5H-THIAZOLO-[2,3-D]-[1,5]-BENZOTHIAZEPINE
SpectraBase Compound ID Cl7EgQR0Mdm
InChI InChI=1S/C20H17NO2S2/c1-2-23-20(22)17-18(14-8-4-3-5-9-14)25-16-11-7-6-10-15(16)21-12-13-24-19(17)21/h3-13,18H,2H2,1H3
InChIKey SSJDYJQOMMASFO-UHFFFAOYSA-N
Mol Weight 367.48 g/mol
Molecular Formula C20H17NO2S2
Exact Mass 367.070071 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5G11wtaq4nb
Name 5-Phenyl-5H-thiazolo[2,3-d][1,5]benzothiazepine-4-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H17NO2S2
InChI InChI=1S/C20H17NO2S2/c1-2-23-20(22)17-18(14-8-4-3-5-9-14)25-16-11-7-6-10-15(16)21-12-13-24-19(17)21/h3-13,18H,2H2,1H3
InChIKey SSJDYJQOMMASFO-UHFFFAOYSA-N
Molecular Weight 367.481 g/mol
SMILES C12=C(C(Sc3c(N2C=CS1)cccc3)c1ccccc1)C(=O)OCC
SPLASH splash10-000i-0039000000-47960d42d64be41ca219
Source of Spectrum KC-0-2214-16
Synonyms Ethyl 5-phenyl-5H-thiazolo[2,3-d][1,5]benzothiazepine-4-carboxylate Ethyl 5-phenyl-5H-[1,3]thiazolo[2,3-d][1,5]benzothiazepine-4-carboxylate
Wiley ID 823098