Vitas-M small molecule compound
(4Z)-4-[2-(2-methoxyphenyl)hydrazinylidene]-5-methyl-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK021205
SMILES COc1ccccc1N/N=C\1/C(=NN(C1=O)c1scc(n1)c1cccc(c1)[N+](=O)[O-])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 C20H16N6O4S MW 436.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N6O4S/c1-12-18(23-22-15-8-3-4-9-17(15)30-2)19(27)25(24-12)20-21-16(11-31-20)13-6-5-7-14(10-13)26(28)29/h3-11,22H,1-2H3/b23-18-InChIKey
UGDMZERNVABDGD-NKFKGCMQSA-NSynonyms
(4Z)4((2METHOXYPHENYL)HYDRAZINYLIDENE)5METHYL2(4(3NITROPHENYL)13THIAZOL2YL)PYRAZOL3ONE
(4Z)4(2(2METHOXYPHENYL)HYDRAZINYLIDENE)5METHYL2(4(3NITROPHENYL)13THIAZOL2YL)24DIHYDRO3HPYRAZOL3ONE
CC1=NN(C(=O)C1=NNC2=CC=CC=C2OC)C3=NC(=CS3)C4=CC(=CC=C4)(N+)(=O)(O)
COc1ccccc1NN=C1C(=NN(C1=O)c1scc(n1)c1cccc(c1)(N+)(=O)(O))C
InChI=1SC20H16N6O4Sc11218(232215834917(15)302)19(27)25(2412)202116(113120)1365714(1013)26(28)29h31122H12H3b2318
MFCD02025964
STK021205
ZINC000012275808
ZINC100296363
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