Vitas-M small molecule compound
methyl 4-(1,3-benzodioxol-5-yl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK095395
SMILES COC(=O)C1=C(C)NC(=S)NC1c1ccc2c(c1)OCO2
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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 C14H14N2O4S MW 306.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14N2O4S/c1-7-11(13(17)18-2)12(16-14(21)15-7)8-3-4-9-10(5-8)20-6-19-9/h3-5,12H,6H2,1-2H3,(H2,15,16,21)InChIKey
QUQRZDUEWOARHA-UHFFFAOYSA-NSynonyms
292853-46-4292853464
CC1=C(C(NC(=S)N1)C2=CC3=C(C=C2)OCO3)C(=O)OC
COC(=O)C1=C(C)NC(=S)NC1c1ccc2c(c1)OCO2
InChI=1SC14H14N2O4Sc1711(13(17)182)12(1614(21)157)834910(58)206199h3512H6H212H3(H2151621)
METHYL4(13BENZODIOXOL5YL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
methyl4(13benzodioxol5yl)6methyl2thioxo1234tetrahydropyrimidine5carboxylate
methyl4(benzo(d)(13)dioxol5yl)6methyl2thioxo1234tetrahydropyrimidine5carboxylate
METHYL6(2HBENZO(34D)13DIOXOLAN5YL)4METHYL2THIOXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
MFCD00417176
STK095395
ZINC000002491377
ZINC000002491378
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