Vitas-M small molecule compound
(2E)-2-{3-chloro-4-[2-(4-cyclohexylphenoxy)ethoxy]-5-ethoxybenzylidene}-N-(prop-2-en-1-yl)hydrazinecarbothioamide
Catalog ID
STK698239
SMILES C=CCNC(=S)N/N=C/c1cc(Cl)c(c(c1)OCC)OCCOc1ccc(cc1)C1CCCCC1
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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 C27H34ClN3O3S MW 516.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34ClN3O3S/c1-3-14-29-27(35)31-30-19-20-17-24(28)26(25(18-20)32-4-2)34-16-15-33-23-12-10-22(11-13-23)21-8-6-5-7-9-21/h3,10-13,17-19,21H,1,4-9,14-16H2,2H3,(H2,29,31,35)/b30-19+InChIKey
FMKMTPYSCGLWGE-NDZAJKAJSA-NSynonyms
(2E)2(3chloro4(2(4cyclohexylphenoxy)ethoxy)5ethoxybenzylidene)N(prop2en1yl)hydrazinecarbothioamide
(E)Nallyl2(3chloro4(2(4cyclohexylphenoxy)ethoxy)5ethoxybenzylidene)hydrazinecarbothioamide
1((E)(3chloro4(2(4cyclohexylphenoxy)ethoxy)5ethoxyphenyl)methylideneamino)3prop2enylthiourea
C=CCNC(=S)NN=Cc1cc(Cl)c(c(c1)OCC)OCCOc1ccc(cc1)C1CCCCC1
CCOC1=C(C(=CC(=C1)C=NNC(=S)NCC=C)Cl)OCCOC2=CC=C(C=C2)C3CCCCC3
InChI=1SC27H34ClN3O3Sc13142927(35)313019201724(28)26(25(1820)3242)3416153323121022(111323)218657921h31013171921H1491416H22H3(H2293135)b3019+
MFCD02988575
ZINC000009310019
ZINC33407579
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