Vitas-M small molecule compound
2-methylpropyl 4-(2-bromophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK812686
SMILES CC(COC(=O)C1=C(C)NC(=S)NC1c1ccccc1Br)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 C16H19BrN2O2S MW 383.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19BrN2O2S/c1-9(2)8-21-15(20)13-10(3)18-16(22)19-14(13)11-6-4-5-7-12(11)17/h4-7,9,14H,8H2,1-3H3,(H2,18,19,22)InChIKey
QJGGUDHPTSIZHV-UHFFFAOYSA-NSynonyms
616212-45-42METHYLPROPYL4(2BROMOPHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
2methylpropyl4(2bromophenyl)6methyl2thioxo1234tetrahydropyrimidine5carboxylate
616212454
CC1=C(C(NC(=S)N1)C2=CC=CC=C2Br)C(=O)OCC(C)C
InChI=1SC16H19BrN2O2Sc19(2)82115(20)1310(3)1816(22)1914(13)11645712(11)17h47914H8H213H3(H2181922)
MFCD04445879
ZINC000004318527
ZINC000004318529
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