SpectraBase Spectrum ID |
Gr1aS7T2zmM |
Name |
6,7-Dimethoxy-1-[2-[N-(4-methylthiophenyl-2,2-dimethyl[1,3]-dioxan-5-yl)amido]benzyl]-1,2,3,4-tetrahydroisoquinoline |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C32H38N2O5S |
InChI |
InChI=1S/C32H38N2O5S/c1-32(2)38-19-27(30(39-32)20-10-12-23(40-5)13-11-20)34-31(35)24-9-7-6-8-21(24)16-26-25-18-29(37-4)28(36-3)17-22(25)14-15-33-26/h6-13,17-18,26-27,30,33H,14-16,19H2,1-5H3,(H,34,35)/t26?,27-,30-/m0/s1 |
InChIKey |
AJUJOHZJHVUJLM-GEULSNLOSA-N |
Molecular Weight |
562.725 g/mol |
SMILES |
N([C@@]1([C@@](OC(OC1)(C)C)(c1ccc(cc1)SC)[H])[H])C(c1c(CC2c3cc(OC)c(cc3CCN2)OC)cccc1)=O |
SPLASH |
splash10-052f-0904000000-49976093d11df269ba50 |
Source of Spectrum |
KD-15-2565-9 |
Wiley ID |
1637137 |