Vitas-M small molecule compound
methyl 6-(4-chlorophenyl)-4-(4-methoxyphenyl)-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL417557
SMILES COC(=O)C1=C(NC(=S)NC1c1ccc(cc1)OC)c1ccc(cc1)Cl
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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 C19H17ClN2O3S MW 388.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17ClN2O3S/c1-24-14-9-5-12(6-10-14)17-15(18(23)25-2)16(21-19(26)22-17)11-3-7-13(20)8-4-11/h3-10,17H,1-2H3,(H2,21,22,26)InChIKey
XAQASZOPOZMGLX-UHFFFAOYSA-NSynonyms
COC1=CC=C(C=C1)C2C(=C(NC(=S)N2)C3=CC=C(C=C3)Cl)C(=O)OC
InChI=1SC19H17ClN2O3Sc124149512(61014)1715(18(23)252)16(2119(26)2217)113713(20)8411h31017H12H3(H2212226)
methyl6(4chlorophenyl)4(4methoxyphenyl)2sulfanylidene34dihydro1Hpyrimidine5carboxylate
methyl6(4chlorophenyl)4(4methoxyphenyl)2thioxo1234tetrahydropyrimidine5carboxylate
MFCD06136303
ZINC000039968987
ZINC000039968988
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