Vitas-M small molecule compound
(2E)-2-(2-{2-[4-(butan-2-yl)phenoxy]ethoxy}-5-chlorobenzylidene)-N-ethylhydrazinecarbothioamide
Catalog ID
STK088017
SMILES CCNC(=S)N/N=C/c1cc(Cl)ccc1OCCOc1ccc(cc1)C(CC)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 C22H28ClN3O2S MW 434.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28ClN3O2S/c1-4-16(3)17-6-9-20(10-7-17)27-12-13-28-21-11-8-19(23)14-18(21)15-25-26-22(29)24-5-2/h6-11,14-16H,4-5,12-13H2,1-3H3,(H2,24,26,29)/b25-15+InChIKey
UYPHKGGUTMMQFG-MFKUBSTISA-NSynonyms
(2E)2(2(2(4(BUTAN2YL)PHENOXY)ETHOXY)5CHLOROBENZYLIDENE)NETHYLHYDRAZINECARBOTHIOAMIDE
1((E)(2(2(4butan2ylphenoxy)ethoxy)5chlorophenyl)methylideneamino)3ethylthiourea
CCC(C)C1=CC=C(C=C1)OCCOC2=C(C=C(C=C2)Cl)C=NNC(=S)NCC
CCNC(=S)NN=Cc1cc(Cl)ccc1OCCOc1ccc(cc1)C(CC)C
InChI=1SC22H28ClN3O2Sc1416(3)176920(10717)271213282111819(23)1418(21)15252622(29)2452h6111416H451213H213H3(H2242629)b2515+
MFCD02044677
STK088017
ZINC000006632037
ZINC000006821443
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