SpectraBase Spectrum ID |
LcXu2qtFU2M |
Name |
S-BENZYL-N-(3,5-DINITROBENZOYL)CYSTEINE N'-(3-METHOXY-4- |
Copyright |
Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula |
C28H29N5O8S |
InChI |
InChI=1S/C28H29N5O8S/c1-3-11-41-25-10-9-20(12-26(25)40-2)16-29-31-28(35)24(18-42-17-19-7-5-4-6-8-19)30-27(34)21-13-22(32(36)37)15-23(14-21)33(38)39/h4-10,12-16,24H,3,11,17-18H2,1-2H3,(H,30,34)(H,31,35)/b29-16+ |
InChIKey |
PZODNYAKJATFAC-MUFRIFMGSA-N |
Molecular Weight |
595.1730 |
SMILES |
N(C(C(N\N=C\c1ccc(OCCC)c(OC)c1)=O)CSCc1ccccc1)C(=O)c1cc(N(=O)=O)cc(N(=O)=O)c1 |
SPLASH |
splash10-0006-9300000000-46c0df8e928e9059d7f7 |
Source of Spectrum |
Chemical Concepts, A Wiley Division, Weinheim, Germany |