Vitas-M small molecule compound
methyl 4-[3-methoxy-4-(3-methylbutoxy)phenyl]-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK869009
SMILES COC(=O)C1=C(C)NC(=S)NC1c1ccc(c(c1)OC)OCCC(C)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 C19H26N2O4S MW 378.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H26N2O4S/c1-11(2)8-9-25-14-7-6-13(10-15(14)23-4)17-16(18(22)24-5)12(3)20-19(26)21-17/h6-7,10-11,17H,8-9H2,1-5H3,(H2,20,21,26)InChIKey
OZIKFCZYBKRDRY-UHFFFAOYSA-NSynonyms
CC1=C(C(NC(=S)N1)C2=CC(=C(C=C2)OCCC(C)C)OC)C(=O)OC
InChI=1SC19H26N2O4Sc111(2)8925147613(1015(14)234)1716(18(22)245)12(3)2019(26)2117h67101117H89H215H3(H2202126)
METHYL4(3METHOXY4(3METHYLBUTOXY)PHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
methyl4(3methoxy4(3methylbutoxy)phenyl)6methyl2thioxo1234tetrahydropyrimidine5carboxylate
MFCD04446240
ZINC000006307940
ZINC000006308020
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