Vitas-M small molecule compound
(4Z)-4-[2-(2-methoxy-5-nitrophenyl)hydrazinylidene]-5-methyl-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK049019
SMILES COc1ccc(cc1N/N=C\1/C(=NN(C1=O)c1scc(n1)c1cccc(c1)[N+](=O)[O-])C)[N+](=O)[O-]
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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 C20H15N7O6S MW 481.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15N7O6S/c1-11-18(23-22-15-9-14(27(31)32)6-7-17(15)33-2)19(28)25(24-11)20-21-16(10-34-20)12-4-3-5-13(8-12)26(29)30/h3-10,22H,1-2H3/b23-18-InChIKey
LOJFYGTUWSGHNJ-NKFKGCMQSA-NSynonyms
(4Z)4((2METHOXY5NITROPHENYL)HYDRAZINYLIDENE)5METHYL2(4(3NITROPHENYL)13THIAZOL2YL)PYRAZOL3ONE
(4Z)4(2(2METHOXY5NITROPHENYL)HYDRAZINYLIDENE)5METHYL2(4(3NITROPHENYL)13THIAZOL2YL)24DIHYDRO3HPYRAZOL3ONE
CC1=NN(C(=O)C1=NNC2=C(C=CC(=C2)(N+)(=O)(O))OC)C3=NC(=CS3)C4=CC(=CC=C4)(N+)(=O)(O)
COc1ccc(cc1NN=C1C(=NN(C1=O)c1scc(n1)c1cccc(c1)(N+)(=O)(O))C)(N+)(=O)(O)
InChI=1SC20H15N7O6Sc11118(232215914(27(31)32)6717(15)332)19(28)25(2411)202116(103420)1243513(812)26(29)30h31022H12H3b2318
MFCD01419008
STK049019
ZINC000009434540
ZINC101439448
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