Vitas-M small molecule compound
methyl 4-(2-chlorophenyl)-6-{[(1-methyl-1H-1,2,4-triazol-5-yl)sulfanyl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL435779
SMILES COC(=O)C1=C(CSc2ncnn2C)NC(=O)NC1c1ccccc1Cl
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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 C16H16ClN5O3S MW 393.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16ClN5O3S/c1-22-16(18-8-19-22)26-7-11-12(14(23)25-2)13(21-15(24)20-11)9-5-3-4-6-10(9)17/h3-6,8,13H,7H2,1-2H3,(H2,20,21,24)InChIKey
XLKDQILQFNMLJJ-UHFFFAOYSA-NSynonyms
CN1C(=NC=N1)SCC2=C(C(NC(=O)N2)C3=CC=CC=C3Cl)C(=O)OC
InChI=1SC16H16ClN5O3Sc12216(1881922)2671112(14(23)252)13(2115(24)2011)9534610(9)17h36813H7H212H3(H2202124)
methyl4(2chlorophenyl)6(((1methyl1H124triazol5yl)sulfanyl)methyl)2oxo1234tetrahydropyrimidine5carboxylate
METHYL4(2CHLOROPHENYL)6((2METHYL124TRIAZOL3YL)SULFANYLMETHYL)2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
MFCD07155717
ZINC000005018416
ZINC000005018420
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