Vitas-M small molecule compound

methyl 4-(3,4-dimethoxyphenyl)-2-oxo-6-(thiomorpholin-4-ylmethyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STL027675
SMILES COC(=O)C1=C(CN2CCSCC2)NC(=O)NC1c1ccc(c(c1)OC)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 C19H25N3O5S MW 407.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H25N3O5S/c1-25-14-5-4-12(10-15(14)26-2)17-16(18(23)27-3)13(20-19(24)21-17)11-22-6-8-28-9-7-22/h4-5,10,17H,6-9,11H2,1-3H3,(H2,20,21,24)
InChIKey
WCVLCGDTHSXHRO-UHFFFAOYSA-N
Synonyms
878701-57-6
878701576
COC1=C(C=C(C=C1)C2C(=C(NC(=O)N2)CN3CCSCC3)C(=O)OC)OC
InChI=1SC19H25N3O5Sc125145412(1015(14)262)1716(18(23)273)13(2019(24)2117)112268289722h451017H6911H213H3(H2202124)
methyl4(34dimethoxyphenyl)2oxo6(thiomorpholin4ylmethyl)1234tetrahydropyrimidine5carboxylate
METHYL4(34DIMETHOXYPHENYL)2OXO6(THIOMORPHOLIN4YLMETHYL)34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
MFCD07155000
ZINC000026455837
ZINC000026455840

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.