4-[4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-8-propan-2-yl-7-thia-1,5,9-triazabicyclo[4.3.0]nona-3,5,8-trien-2-one
Molecular Formula:
C
19
H
18
F
3
N
7
O
5
S
InChI:
InChI=1/C19H18F3N7O5S/c1-10(2)17-24-27-15(30)9-14(23-18(27)35-17)25-3-5-26(6-4-25)16-12(28(31)32)7-11(19(20,21)22)8-13(16)29(33)34/h7-10H,3-6H2,1-2H3
InChIKey:
InChIKey=XBMVANXRKFQBQL-UHFFFAOYAU
SMILES:
CC(C)C1=NN2C(=O)C=C(N=C2S1)N3CCN(CC3)C4=C(C=C(C=C4[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]
Names:
4-[4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-8-propan-2-yl-7-thia-1,5,9-triazabicyclo[4.3.0]nona-3,5,8-trien-2-one
Registries:
PubChem CID 3650191
PubChem ID 9827217
