Vitas-M small molecule compound
2-(ethylsulfanyl)ethyl 4-(6-bromo-1,3-benzodioxol-5-yl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK407204
SMILES CC1=C(C(NC(=O)N1C)c1cc2OCOc2cc1Br)C(=O)OCCSCC
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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 C18H21BrN2O5S MW 457.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21BrN2O5S/c1-4-27-6-5-24-17(22)15-10(2)21(3)18(23)20-16(15)11-7-13-14(8-12(11)19)26-9-25-13/h7-8,16H,4-6,9H2,1-3H3,(H,20,23)InChIKey
UDWBZKZHZDAIPN-UHFFFAOYSA-NSynonyms
313967-84-92(ethylsulfanyl)ethyl4(6bromo13benzodioxol5yl)16dimethyl2oxo1234tetrahydropyrimidine5carboxylate
2ETHYLSULFANYLETHYL6(6BROMO13BENZODIOXOL5YL)34DIMETHYL2OXO16DIHYDROPYRIMIDINE5CARBOXYLATE
313967849
CCSCCOC(=O)C1=C(N(C(=O)NC1C2=CC3=C(C=C2Br)OCO3)C)C
InChI=1SC18H21BrN2O5Sc1427652417(22)1510(2)21(3)18(23)2016(15)1171314(812(11)19)2692513h7816H469H213H3(H2023)
MFCD01151986
ZINC000002074767
ZINC000002074768
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