Vitas-M small molecule compound
(4E)-4-[2-(1,3-benzothiazol-2-yl)hydrazinylidene]-5-methyl-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK006150
SMILES CC1=NN(C(=O)/C/1=N/Nc1nc2c(s1)cccc2)c1ccc(cc1)[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 C17H12N6O3S MW 380.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12N6O3S/c1-10-15(19-20-17-18-13-4-2-3-5-14(13)27-17)16(24)22(21-10)11-6-8-12(9-7-11)23(25)26/h2-9H,1H3,(H,18,20)/b19-15+InChIKey
PZMULTUPPXYPDS-XDJHFCHBSA-NSynonyms
(4E)4(13BENZOTHIAZOL2YLHYDRAZINYLIDENE)5METHYL2(4NITROPHENYL)PYRAZOL3ONE
(4E)4(2(13BENZOTHIAZOL2YL)HYDRAZINYLIDENE)5METHYL2(4NITROPHENYL)24DIHYDRO3HPYRAZOL3ONE
4(BENZOTHIAZOL2YLHYDRAZONO)5METHYL2(4NITROPHENYL)24DIHYDROPYRAZOL3ONE
CC1=NN(C(=O)C1=NNc1nc2c(s1)cccc2)c1ccc(cc1)(N+)(=O)(O)
CC1=NN(C(=O)C1=NNC2=NC3=CC=CC=C3S2)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC17H12N6O3Sc11015(1920171813423514(13)2717)16(24)22(2110)116812(9711)23(25)26h29H1H3(H1820)b1915+
MFCD01418889
STK006150
ZINC000101379370
ZINC13124284
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