3-(4-bromothiophen-2-yl)-7-imino-8-(2-methoxyphenyl)-5-methyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile
Molecular Formula:
C
21
H
15
BrN
4
O
3
S
InChI:
InChI=1/C21H15BrN4O3S/c1-19-16(13-5-3-4-6-14(13)27-2)21(11-25,18(26)29-19)20(9-23,10-24)17(28-19)15-7-12(22)8-30-15/h3-8,16-17,26H,1-2H3/b26-18-
InChIKey:
InChIKey=XGETWTMCTWFMBF-ITYLOYPMBA
SMILES:
CC12C(C(C(=N)O1)(C(C(O2)C3=CC(=CS3)Br)(C#N)C#N)C#N)C4=CC=CC=C4OC
Names:
3-(4-bromothiophen-2-yl)-7-imino-8-(2-methoxyphenyl)-5-methyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile
Registries:
PubChem CID 4469879
PubChem ID 6589915
