Vitas-M small molecule compound
4-(1,3-benzodioxol-5-yl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Catalog ID
STL371724
SMILES S=C1NC(=C(C(N1)c1ccc2c(c1)OCO2)C(=O)N)C
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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 C13H13N3O3S MW 291.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13N3O3S/c1-6-10(12(14)17)11(16-13(20)15-6)7-2-3-8-9(4-7)19-5-18-8/h2-4,11H,5H2,1H3,(H2,14,17)(H2,15,16,20)InChIKey
URBGANHWXDDPNV-UHFFFAOYSA-NSynonyms
4(13BENZODIOXOL5YL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXAMIDE
4(13benzodioxol5yl)6methyl2thioxo1234tetrahydropyrimidine5carboxamide
6(2HBENZO(34D)13DIOXOLEN5YL)4METHYL2THIOXO136TRIHYDROPYRIMIDINE5CARBOXAMIDE
CC1=C(C(NC(=S)N1)C2=CC3=C(C=C2)OCO3)C(=O)N
InChI=1SC13H13N3O3Sc1610(12(14)17)11(1613(20)156)72389(47)195188h2411H5H21H3(H21417)(H2151620)
MFCD02048805
ZINC000004151826
ZINC000004151827
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