4-amino-3-methylsulfanyl-6-tert-butyl-1,2,4-triazin-5-one; 2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline
Molecular Formula:
C
21
H
30
F
3
N
7
O
5
S
InChI:
InChI=1/C13H16F3N3O4.C8H14N4OS/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23;1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h7-8H,3-6H2,1-2H3;9H2,1-4H3
InChIKey:
InChIKey=ILHWFMRVROTIEU-UHFFFAOYAM
SMILES:
CCCN(CCC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-].CC(C)(C)C1=NN=C(N(C1=O)N)SC
Names:
4-amino-3-methylsulfanyl-6-tert-butyl-1,2,4-triazin-5-one; 2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline
Registries:
PubChem CID 171036
PubChem ID 10257555
