Vitas-M small molecule compound
(2E,5E)-5-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methylidene]-2-[(2E)-(1,7,7-trimethylbicyclo[2.2.1]hept-2-ylidene)hydrazinylidene]-1,3-thiazolidin-4-one
Catalog ID
STK955859
SMILES CCn1nc(c(c1)/C=C\1/S/C(=N/N=C/2\CC3C(C2(C)CC3)(C)C)/NC1=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 C20H27N5OS MW 385.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N5OS/c1-6-25-11-13(12(2)24-25)9-15-17(26)21-18(27-15)23-22-16-10-14-7-8-20(16,5)19(14,3)4/h9,11,14H,6-8,10H2,1-5H3,(H,21,23,26)/b15-9+,22-16+InChIKey
CMUXDONAGCQZSA-HSGJKIJMSA-NSynonyms
492425-90-8(2E5E)5((1ethyl3methyl1Hpyrazol4yl)methylidene)2((2E)(177trimethylbicyclo(221)hept2ylidene)hydrazinylidene)13thiazolidin4one
(5E)5((1ethyl3methylpyrazol4yl)methylidene)2((2E)2(477trimethyl3bicyclo(221)heptanylidene)hydrazinyl)13thiazol4one
492425908
5((1ETHYL3METHYLPYRAZOL4YL)METHYLENE)2(2(177TRIMETHYLBICYCLO(221)HEPT2YLIDENE)12DIAZAETHYLIDENE)13THIAZOLIDIN4ONE
CCN1C=C(C(=N1)C)C=C2C(=O)N=C(S2)NN=C3CC4CCC3(C4(C)C)C
CCn1nc(c(c1)C=C1SC(=NN=C2CC3C(C2(C)CC3)(C)C)NC1=O)C
InChI=1SC20H27N5OSc16251113(12(2)2425)91517(26)2118(2715)23221610147820(165)19(143)4h91114H6810H215H3(H212326)b159+2216+
MFCD03073929
ZINC000102223840
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