NSC211172
Molecular Formula:
C25H22BrN9O8
InChI: InChI=1/C19H19BrN6O.C6H3N3O7/c20-10-15(27)24-14-8-6-12(7-9-14)11-23-17-16(13-4-2-1-3-5-13)25-19(22)26-18(17)21;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-9,23H,10-11H2,(H,24,27)(H4,21,22,25,26);1-2,10H/f/h24H,21-22H2;
InChIKey: InChIKey=CVQZAOYBMBOQSA-ABLRMLGFCW
SMILES: C1=CC=C(C=C1)C2=C(C(=NC(=N2)N)N)NCC3=CC=C(C=C3)NC(=O)CBr.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]
Names:
NSC211172
2-bromo-N-[4-[[(2,4-diamino-6-phenyl-pyrimidin-5-yl)amino]methyl]phenyl]acetamide; 2,4,6-trinitrophenol
20768-18-7
Registries:
PubChem CID 309025
PubChem ID 126754
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