For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
4-Hydroxy-3-methoxy-5-[(5-chloro-1,3-benzo[d]thiazo-2-yl)thiomethyl]-.alpha.-carboxamidocinnamonitrile
SpectraBase Compound ID DthT27s1lbS
InChI InChI=1S/C19H14ClN3O3S2/c1-26-15-6-10(4-11(8-21)18(22)25)5-12(17(15)24)9-27-19-23-14-7-13(20)2-3-16(14)28-19/h2-7,24H,9H2,1H3,(H2,22,25)/b11-4+
InChIKey GGFWNDJYHSAUAY-NYYWCZLTSA-N
Mol Weight 431.91 g/mol
Molecular Formula C19H14ClN3O3S2
Exact Mass 431.016511 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 64t91YWoliF
Name 4-Hydroxy-3-methoxy-5-[(5-chloro-1,3-benzo[d]thiazo-2-yl)thiomethyl]-.alpha.-carboxamidocinnamonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H14ClN3O3S2
InChI InChI=1S/C19H14ClN3O3S2/c1-26-15-6-10(4-11(8-21)18(22)25)5-12(17(15)24)9-27-19-23-14-7-13(20)2-3-16(14)28-19/h2-7,24H,9H2,1H3,(H2,22,25)/b11-4+
InChIKey GGFWNDJYHSAUAY-NYYWCZLTSA-N
Molecular Weight 431.912 g/mol
SMILES Oc1c(cc(\C=C\(C(=O)N)C#N)cc1OC)CSc1nc2cc(Cl)ccc2s1
SPLASH splash10-0uxr-0290000000-4217b4fbfc9227203b81
Source of Spectrum E1-36-3560-7
Synonyms (E)-3-[3-[[(5-chloro-1,3-benzothiazol-2-yl)thio]methyl]-4-hydroxy-5-methoxyphenyl]-2-cyano-2-propenamide (E)-3-[3-[(5-chloro-1,3-benzothiazol-2-yl)sulfanylmethyl]-4-hydroxy-5-methoxyphenyl]-2-cyanoprop-2-enamide (E)-3-[3-[(5-chloro-1,3-benzothiazol-2-yl)sulfanylmethyl]-4-hydroxy-5-methoxy-phenyl]-2-cyano-prop-2-enamide (E)-3-[3-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanylmethyl]-5-methoxy-4-oxidanyl-phenyl]-2-cyano-prop-2-enamide
Wiley ID 1574801