| SpectraBase Spectrum ID |
C3778AChs1J |
| Name |
Acetamide, N-[4-[[3-oxo-2-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-1-piperazinyl]sulfonyl]phenyl]- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
499.188940223 u |
| Formula |
C24H29N5O5S |
| InChI |
InChI=1S/C24H29N5O5S/c1-18(30)26-19-7-9-21(10-8-19)35(33,34)29-12-11-25-24(32)22(29)17-23(31)28-15-13-27(14-16-28)20-5-3-2-4-6-20/h2-10,22H,11-17H2,1H3,(H,25,32)(H,26,30) |
| InChIKey |
DKRMKHJLVIGSAG-UHFFFAOYSA-N |
| Molecular Weight |
499.586 g/mol |
| SMILES |
N(C(=O)C)C=1C=CC(S(N2CCNC(C2CC(N2CCN(CC2)C2=CC=CC=C2)=O)=O)(=O)=O)=CC1 |