| SpectraBase Spectrum ID |
DV1lrYQj0QC |
| Name |
2-Ethoxycarbonyl-5-methoxycarbonyl-8-(4-chlorophenyl)-6-methylthio-1,2,3,4-tetrahydroisoquinoline |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H22ClNO4S |
| InChI |
InChI=1S/C21H22ClNO4S/c1-4-27-21(25)23-10-9-15-17(12-23)16(13-5-7-14(22)8-6-13)11-18(28-3)19(15)20(24)26-2/h5-8,11H,4,9-10,12H2,1-3H3 |
| InChIKey |
BYTSXKQVRHNILK-UHFFFAOYSA-N |
| Molecular Weight |
419.923 g/mol |
| SMILES |
c12c(c(-c3ccc(cc3)Cl)cc(c1C(=O)OC)SC)CN(CC2)C(=O)OCC |
| SPLASH |
splash10-0006-0009100000-f27908313560350b577c |
| Source of Spectrum |
SO-0-468-5 |
| Synonyms |
2-Ethyl 5-methyl 8-(4-chlorophenyl)-6-(methylsulfanyl)-3,4-dihydro-2,5(1H)-isoquinolinedicarboxylate |
| Wiley ID |
876412 |
