| SpectraBase Spectrum ID |
7ltOdlwnJyB |
| Name |
2-Ethoxycarbonyl-5-methoxycarbonyl-8-(4-bromophenyl)-6-methylthio-1,2,3,4-tetrahydroisoquinoline |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H22BrNO4S |
| InChI |
InChI=1S/C21H22BrNO4S/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 |
UCDATSONLRUJDQ-UHFFFAOYSA-N |
| Molecular Weight |
464.374 g/mol |
| SMILES |
c12c(c(-c3ccc(cc3)Br)cc(c1C(=O)OC)SC)CN(CC2)C(=O)OCC |
| SPLASH |
splash10-0019-0000900000-e5426992ec2cb04ed26d |
| Source of Spectrum |
SO-0-470-5 |
| Synonyms |
2-Ethyl 5-methyl 8-(4-bromophenyl)-6-(methylsulfanyl)-3,4-dihydro-2,5(1H)-isoquinolinedicarboxylate
2-O-ethyl 5-O-methyl 8-(4-bromophenyl)-6-methylsulfanyl-3,4-dihydro-1H-isoquinoline-2,5-dicarboxylate
O2-ethyl O5-methyl 8-(4-bromophenyl)-6-methylsulfanyl-3,4-dihydro-1H-isoquinoline-2,5-dicarboxylate |
| Wiley ID |
876411 |
