SpectraBase Spectrum ID |
9064KEsl8TB |
Name |
(S)-1-(2-Carboxy-1,3-dithian-2-yl)-2-(4-methylbenzenesulfonamido)-4-methylpentane |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H27NO4S3 |
InChI |
InChI=1S/C18H27NO4S3/c1-13(2)11-15(12-18(17(20)21)24-9-4-10-25-18)19-26(22,23)16-7-5-14(3)6-8-16/h5-8,13,15,19H,4,9-12H2,1-3H3,(H,20,21)/t15-/m0/s1 |
InChIKey |
ACYKTVSQYCPZFN-HNNXBMFYSA-N |
Molecular Weight |
417.597 g/mol |
SMILES |
N(S(c1ccc(cc1)C)(=O)=O)[C@](CC1(C(=O)O)SCCCS1)(CC(C)C)[H] |
SPLASH |
splash10-0006-7090000000-030aaca0b7f6fd7b4ba0 |
Source of Spectrum |
KC-0-2441-20 |
Synonyms |
2-[(2S)-4-methyl-2-(p-tolylsulfonylamino)pentyl]-1,3-dithiane-2-carboxylic acid
2-[(2S)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentyl]-1,3-dithiane-2-carboxylic acid |
Wiley ID |
784284 |