Vitas-M small molecule compound
(4E)-5-methyl-2-(4-methylphenyl)-4-[(3-methylthiophen-2-yl)methylidene]-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK075720
SMILES Cc1ccc(cc1)N1N=C(/C(=C\c2sccc2C)/C1=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 C17H16N2OS MW 296.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2OS/c1-11-4-6-14(7-5-11)19-17(20)15(13(3)18-19)10-16-12(2)8-9-21-16/h4-10H,1-3H3/b15-10+InChIKey
YKUMGCPORBSQGL-XNTDXEJSSA-NSynonyms
(4E)5METHYL2(4METHYLPHENYL)4((3METHYLTHIOPHEN2YL)METHYLIDENE)24DIHYDRO3HPYRAZOL3ONE
(4E)5METHYL2(4METHYLPHENYL)4((3METHYLTHIOPHEN2YL)METHYLIDENE)PYRAZOL3ONE
CC1=CC=C(C=C1)N2C(=O)C(=CC3=C(C=CS3)C)C(=N2)C
Cc1ccc(cc1)N1N=C(C(=Cc2sccc2C)C1=O)C
InChI=1SC17H16N2OSc1114614(7511)1917(20)15(13(3)1819)101612(2)892116h410H13H3b1510+
MFCD03035438
STK075720
ZINC000004558265
ZINC04558265
ZINC4558265
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