Vitas-M small molecule compound
(2E)-2-{4-[3-(4-tert-butylphenoxy)propoxy]-3-chloro-5-methoxybenzylidene}hydrazinecarboxamide
Catalog ID
STK028086
SMILES COc1cc(/C=N/NC(=O)N)cc(c1OCCCOc1ccc(cc1)C(C)(C)C)Cl
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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 C22H28ClN3O4 MW 433.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28ClN3O4/c1-22(2,3)16-6-8-17(9-7-16)29-10-5-11-30-20-18(23)12-15(13-19(20)28-4)14-25-26-21(24)27/h6-9,12-14H,5,10-11H2,1-4H3,(H3,24,26,27)/b25-14+InChIKey
XGAWQYLWIGKTKV-AFUMVMLFSA-NSynonyms
((E)(4(3(4tertbutylphenoxy)propoxy)3chloro5methoxyphenyl)methylideneamino)urea
(2E)2(4(3(4TERTBUTYLPHENOXY)PROPOXY)3CHLORO5METHOXYBENZYLIDENE)HYDRAZINECARBOXAMIDE
CC(C)(C)C1=CC=C(C=C1)OCCCOC2=C(C=C(C=C2Cl)C=NNC(=O)N)OC
COc1cc(C=NNC(=O)N)cc(c1OCCCOc1ccc(cc1)C(C)(C)C)Cl
InChI=1SC22H28ClN3O4c122(23)166817(9716)2910511302018(23)1215(1319(20)284)14252621(24)27h691214H51011H214H3(H3242627)b2514+
MFCD05975498
STK028086
ZINC000013940736
ZINC101411466
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