Vitas-M small molecule compound
(4Z)-4-[2-(2-bromophenyl)hydrazinylidene]-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-5-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK006036
SMILES COc1ccc(cc1)c1csc(n1)N1N=C(/C(=N/Nc2ccccc2Br)/C1=O)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 C25H17BrN6O4S MW 577.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17BrN6O4S/c1-36-18-12-8-15(9-13-18)21-14-37-25(27-21)31-24(33)23(29-28-20-5-3-2-4-19(20)26)22(30-31)16-6-10-17(11-7-16)32(34)35/h2-14,28H,1H3/b29-23-InChIKey
IRCKBUMFIGULOS-FAJYDZGRSA-NSynonyms
(4Z)4((2BROMOPHENYL)HYDRAZINYLIDENE)2(4(4METHOXYPHENYL)13THIAZOL2YL)5(4NITROPHENYL)PYRAZOL3ONE
(4Z)4(2(2BROMOPHENYL)HYDRAZINYLIDENE)2(4(4METHOXYPHENYL)13THIAZOL2YL)5(4NITROPHENYL)24DIHYDRO3HPYRAZOL3ONE
COC1=CC=C(C=C1)C2=CSC(=N2)N3C(=O)C(=NNC4=CC=CC=C4Br)C(=N3)C5=CC=C(C=C5)(N+)(=O)(O)
COc1ccc(cc1)c1csc(n1)N1N=C(C(=NNc2ccccc2Br)C1=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC25H17BrN6O4Sc1361812815(91318)21143725(2721)3124(33)23(292820532419(20)26)22(3031)1661017(11716)32(34)35h21428H1H3b2923
MFCD01418539
STK006036
ZINC000008397571
ZINC08397571
ZINC100005908
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