Vitas-M small molecule compound
1,1'',5,5''-tetramethyl-1'-(4-nitrobenzyl)-1H,1'H,1''H-4,3':5',4''-terpyrazole
Catalog ID
STL413075
SMILES Cn1ncc(c1C)c1cc(nn1Cc1ccc(cc1)[N+](=O)[O-])c1cnn(c1C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C20H21N7O2 MW 391.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N7O2/c1-13-17(10-21-24(13)3)19-9-20(18-11-22-25(4)14(18)2)26(23-19)12-15-5-7-16(8-6-15)27(28)29/h5-11H,12H2,1-4H3InChIKey
GXIBHBGOIXWGHW-UHFFFAOYSA-NSynonyms
1006993-62-91006993629
1155tetramethyl1(4nitrobenzyl)1H1H1H4354terpyrazole
35bis(15dimethylpyrazol4yl)1((4nitrophenyl)methyl)pyrazole
CC1=C(C=NN1C)C2=CC(=NN2CC3=CC=C(C=C3)(N+)(=O)(O))C4=C(N(N=C4)C)C
Cn1ncc(c1C)c1cc(nn1Cc1ccc(cc1)(N+)(=O)(O))c1cnn(c1C)C
InChI=1SC20H21N7O2c11317(102124(13)3)19920(18112225(4)14(18)2)26(2319)12155716(8615)27(28)29h511H12H214H3
MFCD08553149
ZINC000036611613
ZINC36611613
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