| SpectraBase Spectrum ID |
JqUIKgyIKUW |
| Name |
syn and Anti-methyl 2-[(diphenylmethylene)amino]-3-(4-methylphenylsulfonamide)-3-(2-furyl)propanoate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
502.156243114 u |
| Formula |
C28H26N2O5S |
| InChI |
InChI=1S/C28H26N2O5S/c1-20-15-17-23(18-16-20)36(32,33)30-26(24-14-9-19-35-24)27(28(31)34-2)29-25(21-10-5-3-6-11-21)22-12-7-4-8-13-22/h3-19,26-27,30H,1-2H3 |
| InChIKey |
CUCMRMXXIPYIEG-UHFFFAOYSA-N |
| Molecular Weight |
502.585 g/mol |
| SMILES |
C(NS(C=1C=CC(=CC1)C)(=O)=O)(C(N=C(C1=CC=CC=C1)C1=CC=CC=C1)C(=O)OC)C=1OC=CC1 |