Vitas-M small molecule compound
(2E)-N-{2-[(3,4-dichlorobenzyl)sulfanyl]ethyl}-3-phenylprop-2-enamide
Catalog ID
STL121034
SMILES O=C(/C=C/c1ccccc1)NCCSCc1ccc(c(c1)Cl)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 C18H17Cl2NOS MW 366.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17Cl2NOS/c19-16-8-6-15(12-17(16)20)13-23-11-10-21-18(22)9-7-14-4-2-1-3-5-14/h1-9,12H,10-11,13H2,(H,21,22)/b9-7+InChIKey
VBTTXKORTQERJY-VQHVLOKHSA-NSynonyms
(2E)N(2((34dichlorobenzyl)sulfanyl)ethyl)3phenylprop2enamide
(E)N(2((34DICHLOROPHENYL)METHYLSULFANYL)ETHYL)3PHENYLPROP2ENAMIDE
C1=CC=C(C=C1)C=CC(=O)NCCSCC2=CC(=C(C=C2)Cl)Cl
InChI=1SC18H17Cl2NOSc19168615(1217(16)20)132311102118(22)97144213514h1912H101113H2(H2122)b97+
MFCD03142355
O=C(C=Cc1ccccc1)NCCSCc1ccc(c(c1)Cl)Cl
ZINC000002984531
ZINC02984531
ZINC2984531
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