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

*Links on SpectraBase are not permalinks.
4-Thiazolone, 5-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]dihydro-3-(3-pyridinylmethyl)-2-thioxo-
SpectraBase Compound ID 59kAgTXGAkm
InChI InChI=1S/C17H11BrN2O3S2/c18-12-6-14-13(22-9-23-14)4-11(12)5-15-16(21)20(17(24)25-15)8-10-2-1-3-19-7-10/h1-7H,8-9H2/b15-5-
InChIKey JPZQQVNGTKNGAW-WCSRMQSCSA-N
Mol Weight 435.31 g/mol
Molecular Formula C17H11BrN2O3S2
Exact Mass 433.939448 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 DhoyqKIY8go
Name 4-Thiazolone, 5-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]dihydro-3-(3-pyridinylmethyl)-2-thioxo-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H11BrN2O3S2
InChI InChI=1S/C17H11BrN2O3S2/c18-12-6-14-13(22-9-23-14)4-11(12)5-15-16(21)20(17(24)25-15)8-10-2-1-3-19-7-10/h1-7H,8-9H2/b15-5-
InChIKey JPZQQVNGTKNGAW-WCSRMQSCSA-N
Molecular Weight 435.310 g/mol
SMILES c1cncc(CN2C(S\C(C2=O)=C\c2c(cc3c(c2)OCO3)Br)=S)c1
SPLASH splash10-0a4i-8973000000-bc7be82c2bea2e049422
Source of Spectrum IY-1-4540-9
Synonyms (5Z)-5-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-3-(3-pyridinylmethyl)-2-sulfanylidene-4-thiazolidinone (5Z)-5-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-3-(pyridin-3-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one (5Z)-5-[(6-bromanyl-1,3-benzodioxol-5-yl)methylidene]-3-(pyridin-3-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Wiley ID 1653392