| SpectraBase Spectrum ID |
J4K1shWfTNp |
| Name |
2(S)-N-[2-(2,4-Dibromo-5-methoxyphenyl)-2-(thiophenyl)ethane]-1-methyl-2-pyrrolinecarboxamide |
| Alternate Name(s) |
(2S)-N-[2-(2,4-dibromo-5-methoxyphenyl)-2-(phenylthio)ethyl]-1-methyl-2-pyrrolidinecarboxamide
(2S)-N-[2-(2,4-dibromo-5-methoxyphenyl)-2-phenylsulfanylethyl]-1-methylpyrrolidine-2-carboxamide
(2S)-N-[2-(2,4-dibromo-5-methoxy-phenyl)-2-phenylsulfanyl-ethyl]-1-methyl-pyrrolidine-2-carboxamide
(2S)-N-[2-[2,4-bis(bromanyl)-5-methoxy-phenyl]-2-phenylsulfanyl-ethyl]-1-methyl-pyrrolidine-2-carboxamide |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H24Br2N2O2S |
| InChI |
InChI=1S/C21H24Br2N2O2S/c1-25-10-6-9-18(25)21(26)24-13-20(28-14-7-4-3-5-8-14)15-11-19(27-2)17(23)12-16(15)22/h3-5,7-8,11-12,18,20H,6,9-10,13H2,1-2H3,(H,24,26)/t18-,20?/m0/s1 |
| InChIKey |
JQYPYNNKXTZNLZ-LROBGIAVSA-N |
| Molecular Weight |
528.303 g/mol |
| SMILES |
N(C([C@]1(N(CCC1)C)[H])=O)CC(c1c(cc(c(c1)OC)Br)Br)Sc1ccccc1 |
| SPLASH |
splash10-003r-7000090000-e009d0cac2c3b8f1a9ab |
| Source of Spectrum |
KD-13-2264-12 |
| Wiley ID |
1635491 |
![2(S)-N-[2-(2,4-Dibromo-5-methoxyphenyl)-2-(thiophenyl)ethane]-1-methyl-2-pyrrolinecarboxamide](/api/spectrum/J4K1shWfTNp/structure.png?h=300&w=458 "2(S)-N-[2-(2,4-Dibromo-5-methoxyphenyl)-2-(thiophenyl)ethane]-1-methyl-2-pyrrolinecarboxamide")
