Vitas-M small molecule compound

5-[(Z)-(1-ethyl-5-oxo-2-thioxoimidazolidin-4-ylidene)methyl]-2-methoxybenzyl acetate

Catalog ID
STL176405
SMILES CCN1C(=S)N/C(=C\c2ccc(c(c2)COC(=O)C)OC)/C1=O

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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 C16H18N2O4S MW 334.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2O4S/c1-4-18-15(20)13(17-16(18)23)8-11-5-6-14(21-3)12(7-11)9-22-10(2)19/h5-8H,4,9H2,1-3H3,(H,17,23)/b13-8-
InChIKey
AIOCQCUXOUFTEA-JYRVWZFOSA-N
Synonyms
723326-35-0
(5((Z)(1ETHYL5OXO2SULFANYLIDENEIMIDAZOLIDIN4YLIDENE)METHYL)2METHOXYPHENYL)METHYLACETATE
5((Z)(1ethyl5oxo2thioxoimidazolidin4ylidene)methyl)2methoxybenzylacetate
723326350
CCN1C(=O)C(=CC2=CC(=C(C=C2)OC)COC(=O)C)NC1=S
CCN1C(=S)NC(=Cc2ccc(c(c2)COC(=O)C)OC)C1=O
InChI=1SC16H18N2O4Sc141815(20)13(1716(18)23)8115614(213)12(711)92210(2)19h58H49H213H3(H1723)b138
MFCD04048648
ZINC000006401047
ZINC06401047
ZINC6401047

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Available files

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