Vitas-M small molecule compound

ethyl 4-[4-methoxy-3-(methoxymethyl)phenyl]-2-oxo-6-(thiomorpholin-4-ylmethyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK314325
SMILES CCOC(=O)C1=C(CN2CCSCC2)NC(=O)NC1c1ccc(c(c1)COC)OC

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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 C21H29N3O5S MW 435.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N3O5S/c1-4-29-20(25)18-16(12-24-7-9-30-10-8-24)22-21(26)23-19(18)14-5-6-17(28-3)15(11-14)13-27-2/h5-6,11,19H,4,7-10,12-13H2,1-3H3,(H2,22,23,26)
InChIKey
NTQYZPHWZQYTOX-UHFFFAOYSA-N
Synonyms
832746-28-8
832746288
CCOC(=O)C1=C(NC(=O)NC1C2=CC(=C(C=C2)OC)COC)CN3CCSCC3
ethyl4(4methoxy3(methoxymethyl)phenyl)2oxo6(thiomorpholin4ylmethyl)1234tetrahydropyrimidine5carboxylate
ethyl4(4methoxy3(methoxymethyl)phenyl)2oxo6(thiomorpholin4ylmethyl)34dihydro1Hpyrimidine5carboxylate
InChI=1SC21H29N3O5Sc142920(25)1816(1224793010824)2221(26)2319(18)145617(283)15(1114)13272h561119H47101213H213H3(H2222326)
MFCD05667696
ZINC000013960852
ZINC000013960853

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Available files

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