Vitas-M small molecule compound
(4Z)-4-[2-(5-chloro-2-methylphenyl)hydrazinylidene]-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK093669
SMILES COc1ccc(cc1)c1csc(n1)N1N=C(/C(=N/Nc2cc(Cl)ccc2C)/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 C21H18ClN5O2S MW 439.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN5O2S/c1-12-4-7-15(22)10-17(12)24-25-19-13(2)26-27(20(19)28)21-23-18(11-30-21)14-5-8-16(29-3)9-6-14/h4-11,24H,1-3H3/b25-19-InChIKey
MMLIWTBSECJQIQ-PLRJNAJWSA-NSynonyms
(4Z)4((5CHLORO2METHYLPHENYL)HYDRAZINYLIDENE)2(4(4METHOXYPHENYL)13THIAZOL2YL)5METHYLPYRAZOL3ONE
(4Z)4(2(5CHLORO2METHYLPHENYL)HYDRAZINYLIDENE)2(4(4METHOXYPHENYL)13THIAZOL2YL)5METHYL24DIHYDRO3HPYRAZOL3ONE
CC1=C(C=C(C=C1)Cl)NN=C2C(=NN(C2=O)C3=NC(=CS3)C4=CC=C(C=C4)OC)C
COc1ccc(cc1)c1csc(n1)N1N=C(C(=NNc2cc(Cl)ccc2C)C1=O)C
InChI=1SC21H18ClN5O2Sc1124715(22)1017(12)24251913(2)2627(20(19)28)212318(113021)145816(293)9614h41124H13H3b2519
MFCD01418977
STK093669
ZINC000012462349
ZINC100527752
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