Vitas-M small molecule compound
2-amino-4-{[2-(3,4-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-6-(methylsulfanyl)pyrimidine-5-carbonitrile
Catalog ID
STK525636
SMILES COc1cc(ccc1OC)C(=O)CSc1nc(N)nc(c1C#N)SC
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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 C16H16N4O3S2 MW 376.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O3S2/c1-22-12-5-4-9(6-13(12)23-2)11(21)8-25-15-10(7-17)14(24-3)19-16(18)20-15/h4-6H,8H2,1-3H3,(H2,18,19,20)InChIKey
WBRHHBIZILXLIR-UHFFFAOYSA-NSynonyms
340807-53-62amino4((2(34dimethoxyphenyl)2oxoethyl)sulfanyl)6(methylsulfanyl)pyrimidine5carbonitrile
2amino4((2(34dimethoxyphenyl)2oxoethyl)thio)6(methylthio)pyrimidine5carbonitrile
2AMINO4(2(34DIMETHOXYPHENYL)2OXOETHYL)SULFANYL6METHYLSULFANYLPYRIMIDINE5CARBONITRILE
340807536
COC1=C(C=C(C=C1)C(=O)CSC2=NC(=NC(=C2C#N)SC)N)OC
InChI=1SC16H16N4O3S2c12212549(613(12)232)11(21)8251510(717)14(243)1916(18)2015h46H8H213H3(H2181920)
MFCD01242928
ZINC000002318468
ZINC02318468
ZINC2318468
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