SpectraBase Spectrum ID |
FF36V5pxiJC |
Name |
4-[2-Amino-4-(benzo[d][1,3]dioxol-5yl)-3-cyano-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 |
C23H22N4O4S |
InChI |
InChI=1S/C23H22N4O4S/c24-12-18-22(14-5-10-20-21(11-14)31-13-30-20)17-3-1-2-4-19(17)27(23(18)25)15-6-8-16(9-7-15)32(26,28)29/h5-11,22H,1-4,13,25H2,(H2,26,28,29) |
InChIKey |
JZNCSWFSJOOTMD-UHFFFAOYSA-N |
Molecular Weight |
450.513 g/mol |
SMILES |
NS(c1ccc(N2C3=C(C(C(=C2N)C#N)c2cc4OCOc4cc2)CCCC3)cc1)(=O)=O |
SPLASH |
splash10-0006-9000000000-5ebb49b9d3e6184d9826 |
Source of Spectrum |
F2-45-3017-6h |
Synonyms |
4-[2-azanyl-4-(1,3-benzodioxol-5-yl)-3-cyano-5,6,7,8-tetrahydro-4H-quinolin-1-yl]benzenesulfonamide |
Wiley ID |
1689226 |