SpectraBase Spectrum ID |
L8YQgaxJgWr |
Name |
4-[2-Amino-3-cyano-4-(3-nitrophenyl)-5,6,7,8-tetrahydroquinolin-1(4H)-yl]benzenesulfonamide |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H21N5O4S |
InChI |
InChI=1S/C22H21N5O4S/c23-13-19-21(14-4-3-5-16(12-14)27(28)29)18-6-1-2-7-20(18)26(22(19)24)15-8-10-17(11-9-15)32(25,30)31/h3-5,8-12,21H,1-2,6-7,24H2,(H2,25,30,31) |
InChIKey |
KXAQAFOAFFHHJQ-UHFFFAOYSA-N |
Molecular Weight |
451.501 g/mol |
SMILES |
NS(c1ccc(N2C=3CCCCC3C(C(=C2N)C#N)c2cc(N(=O)=O)ccc2)cc1)(=O)=O |
SPLASH |
splash10-0006-9000000000-60340d32b38564699fb9 |
Source of Spectrum |
F2-45-3017-6i |
Synonyms |
4-[2-azanyl-3-cyano-4-(3-nitrophenyl)-5,6,7,8-tetrahydro-4H-quinolin-1-yl]benzenesulfonamide |
Wiley ID |
1689227 |