3-(3-nitrophenyl)-9-[(4-tert-butylphenoxy)methyl]-5-thia-1,2,7,8-tetrazabicyclo[4.3.0]nona-3,6,8-triene
Molecular Formula:
C21H21N5O3S
InChI: InChI=1/C21H21N5O3S/c1-21(2,3)15-7-9-17(10-8-15)29-12-19-22-23-20-25(19)24-18(13-30-20)14-5-4-6-16(11-14)26(27)28/h4-11,13,24H,12H2,1-3H3
InChIKey: InChIKey=JGCIFWREZMLADH-UHFFFAOYAG
SMILES: CC(C)(C)C1=CC=C(C=C1)OCC2=NN=C3N2NC(=CS3)C4=CC(=CC=C4)[N+](=O)[O-]
Names:
3-(3-nitrophenyl)-9-[(4-tert-butylphenoxy)methyl]-5-thia-1,2,7,8-tetrazabicyclo[4.3.0]nona-3,6,8-triene
Registries:
PubChem CID 4112096
PubChem ID 6038226
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