| SpectraBase Spectrum ID |
LbUbnQ50uNM |
| Name |
Ethyl 2-[3'-(3''-methyl-1"-hydroxycarbonylbutyl)thioureido)pyridine-3-carboxylate |
| Alternate Name(s) |
Ethyl 2-[3'-(3''-methyl-1''-hydroxycarbonylbutyl)thioureido)pyridine-3-carboxylate
N-({[3-(ethoxycarbonyl)-2-pyridinyl]amino}carbothioyl)leucine |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H21N3O4S |
| InChI |
InChI=1S/C15H21N3O4S/c1-4-22-14(21)10-6-5-7-16-12(10)18-15(23)17-11(13(19)20)8-9(2)3/h5-7,9,11H,4,8H2,1-3H3,(H,19,20)(H2,16,17,18,23) |
| InChIKey |
WHTOSARYAPQTIK-UHFFFAOYSA-N |
| Molecular Weight |
339.410 g/mol |
| SMILES |
N(c1c(C(=O)OCC)cccn1)C(NC(C(=O)O)CC(C)C)=S |
| SPLASH |
splash10-001r-0096000000-194867a9f58305e13f5a |
| Source of Spectrum |
Y-32-71-7 |
| Wiley ID |
1334349 |
