Vitas-M small molecule compound
ethyl 4-(3-bromophenyl)-2-oxo-6-(thiomorpholin-4-ylmethyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL107614
SMILES CCOC(=O)C1=C(CN2CCSCC2)NC(=O)NC1c1cccc(c1)Br
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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 C18H22BrN3O3S MW 440.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22BrN3O3S/c1-2-25-17(23)15-14(11-22-6-8-26-9-7-22)20-18(24)21-16(15)12-4-3-5-13(19)10-12/h3-5,10,16H,2,6-9,11H2,1H3,(H2,20,21,24)InChIKey
FATRTIHZBNQUKD-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=O)NC1C2=CC(=CC=C2)Br)CN3CCSCC3
ethyl4(3bromophenyl)2oxo6(thiomorpholin4ylmethyl)1234tetrahydropyrimidine5carboxylate
ethyl4(3bromophenyl)2oxo6(thiomorpholin4ylmethyl)34dihydro1Hpyrimidine5carboxylate
InChI=1SC18H22BrN3O3Sc122517(23)1514(112268269722)2018(24)2116(15)1243513(19)1012h351016H26911H21H3(H2202124)
MFCD20741550
ZINC000067286192
ZINC000067286193
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