| SpectraBase Spectrum ID |
LwxtxDa5qKJ |
| Name |
Sulfoximine, N-[2-(methoxycarbonyl)-3,6-dioxo-4-(phenylamino)-1,4-cyclohexadien-1-yl]-S,S-di(methyl-D3)- |
| Alternate Name(s) |
5-Anilino-3-methoxycarbonyl-2-hexadeuteriodimethylsulfoximido-1,4-benzoquinone |
| CAS Registry Number |
99336-60-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H10D6N2O5S |
| InChI |
InChI=1S/C16H16N2O5S/c1-23-16(21)13-14(18-24(2,3)22)12(19)9-11(15(13)20)17-10-7-5-4-6-8-10/h4-9,17H,1-3H3/i2D3,3D3 |
| InChIKey |
HCAMKVHNRDDJFU-XERRXZQWSA-N |
| Molecular Weight |
354.410 g/mol |
| SMILES |
N(C1=CC(C(=C(C1=O)C(=O)OC)N=S(=O)(C([2D])([2D])[2D])C([2D])([2D])[2D])=O)c1ccccc1 |
| SPLASH |
splash10-0006-0904000000-6d5c841f7467e086fdb6 |
| Source of Spectrum |
Y-22-709-5 |
| Wiley ID |
1340384 |
![Sulfoximine, N-[2-(methoxycarbonyl)-3,6-dioxo-4-(phenylamino)-1,4-cyclohexadien-1-yl]-S,S-di(methyl-D3)-](/api/spectrum/LwxtxDa5qKJ/structure.png?h=300&w=458 "Sulfoximine, N-[2-(methoxycarbonyl)-3,6-dioxo-4-(phenylamino)-1,4-cyclohexadien-1-yl]-S,S-di(methyl-D3)-")
