Vitas-M small molecule compound
(4Z)-4-[2-(3-methoxyphenyl)hydrazinylidene]-5-(4-nitrophenyl)-2-(4-phenyl-1,3-thiazol-2-yl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK077831
SMILES COc1cccc(c1)N/N=C\1/C(=NN(C1=O)c1scc(n1)c1ccccc1)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 C25H18N6O4S MW 498.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18N6O4S/c1-35-20-9-5-8-18(14-20)27-28-23-22(17-10-12-19(13-11-17)31(33)34)29-30(24(23)32)25-26-21(15-36-25)16-6-3-2-4-7-16/h2-15,27H,1H3/b28-23-InChIKey
BZEPKMQWQYCECC-NFFVHWSESA-NSynonyms
(4Z)4((3methoxyphenyl)hydrazinylidene)5(4nitrophenyl)2(4phenyl13thiazol2yl)pyrazol3one
(4Z)4(2(3METHOXYPHENYL)HYDRAZINYLIDENE)5(4NITROPHENYL)2(4PHENYL13THIAZOL2YL)24DIHYDRO3HPYRAZOL3ONE
COC1=CC=CC(=C1)NN=C2C(=NN(C2=O)C3=NC(=CS3)C4=CC=CC=C4)C5=CC=C(C=C5)(N+)(=O)(O)
COc1cccc(c1)NN=C1C(=NN(C1=O)c1scc(n1)c1ccccc1)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC25H18N6O4Sc1352095818(1420)27282322(17101219(131117)31(33)34)2930(24(23)32)252621(153625)166324716h21527H1H3b2823
MFCD01418508
STK077831
ZINC000009659921
ZINC101478526
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