| SpectraBase Spectrum ID |
A9xuAx8ftVz |
| Name |
2-[2-(1H-Indol-3-yl)ethylamino]-4,4-dimethyl-6-oxidanylidene-N-phenyl-cyclohexene-1-carbothioamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
417.187483674 u |
| Formula |
C25H27N3OS |
| InChI |
InChI=1S/C25H27N3OS/c1-25(2)14-21(26-13-12-17-16-27-20-11-7-6-10-19(17)20)23(22(29)15-25)24(30)28-18-8-4-3-5-9-18/h3-11,16,26-27H,12-15H2,1-2H3,(H,28,30) |
| InChIKey |
BANSENSAGYJFBS-UHFFFAOYSA-N |
| Molecular Weight |
417.571 g/mol |
| SMILES |
C1(C(NC=2C=CC=CC2)=S)=C(CC(C)(C)CC1=O)NCCC1=CNC2=C1C=CC=C2 |
![2-[2-(1H-indol-3-yl)ethylamino]-4,4-dimethyl-6-oxidanylidene-N-phenyl-cyclohexene-1-carbothioamide](/api/spectrum/A9xuAx8ftVz/structure.png?h=300&w=458 "2-[2-(1H-indol-3-yl)ethylamino]-4,4-dimethyl-6-oxidanylidene-N-phenyl-cyclohexene-1-carbothioamide")
