SpectraBase Spectrum ID |
1ZfXvZt31rE |
Name |
Methanone, [3-amino-5-[(2,4-dimethylphenyl)amino]-4-[(4-methylphenyl)sulfonyl]-2-thienyl]phenyl- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
476.122834986 u |
Formula |
C26H24N2O3S2 |
InChI |
InChI=1S/C26H24N2O3S2/c1-16-9-12-20(13-10-16)33(30,31)25-22(27)24(23(29)19-7-5-4-6-8-19)32-26(25)28-21-14-11-17(2)15-18(21)3/h4-15,28H,27H2,1-3H3 |
InChIKey |
QMBWVWOIXNSLSC-UHFFFAOYSA-N |
Molecular Weight |
476.609 g/mol |
SMILES |
C=1(C(=C(C(=O)C2=CC=CC=C2)SC1NC=1C(=CC(=CC1)C)C)N)S(C=1C=CC(=CC1)C)(=O)=O |