Vitas-M small molecule compound
(5E)-5-(3-chloro-4-ethoxybenzylidene)-1-(2-ethylphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK196944
SMILES CCOc1ccc(cc1Cl)/C=C/1\C(=O)NC(=S)N(C1=O)c1ccccc1CC
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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 C21H19ClN2O3S MW 414.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN2O3S/c1-3-14-7-5-6-8-17(14)24-20(26)15(19(25)23-21(24)28)11-13-9-10-18(27-4-2)16(22)12-13/h5-12H,3-4H2,1-2H3,(H,23,25,28)/b15-11+InChIKey
IKJHAZARHMGLEE-RVDMUPIBSA-NSynonyms
(5E)5((3CHLORO4ETHOXYPHENYL)METHYLIDENE)1(2ETHYLPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5(3CHLORO4ETHOXYBENZYLIDENE)1(2ETHYLPHENYL)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
5((3CHLORO4ETHOXYPHENYL)METHYLENE)1(2ETHYLPHENYL)2THIOXO13DIHYDROPYRIMIDINE46DIONE
CCC1=CC=CC=C1N2C(=O)C(=CC3=CC(=C(C=C3)OCC)Cl)C(=O)NC2=S
CCOc1ccc(cc1Cl)C=C1C(=O)NC(=S)N(C1=O)c1ccccc1CC
InChI=1SC21H19ClN2O3Sc1314756817(14)2420(26)15(19(25)2321(24)28)111391018(2742)16(22)1213h512H34H212H3(H232528)b1511+
MFCD03547805
ZINC000004738861
ZINC04738861
ZINC4738861
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