Vitas-M small molecule compound
(5E)-5-{4-[(4-chlorobenzyl)oxy]benzylidene}-1-(prop-2-en-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK188099
SMILES C=CCN1C(=S)NC(=O)/C(=C\c2ccc(cc2)OCc2ccc(cc2)Cl)/C1=O
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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 C21H17ClN2O3S MW 412.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN2O3S/c1-2-11-24-20(26)18(19(25)23-21(24)28)12-14-5-9-17(10-6-14)27-13-15-3-7-16(22)8-4-15/h2-10,12H,1,11,13H2,(H,23,25,28)/b18-12+InChIKey
ZJUXWPOZZYUDAG-LDADJPATSA-NSynonyms
(5E)5((4((4CHLOROPHENYL)METHOXY)PHENYL)METHYLIDENE)1PROP2ENYL2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5(4((4CHLOROBENZYL)OXY)BENZYLIDENE)1(PROP2EN1YL)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
1ALLYL5(4((4CHLOROBENZYL)OXY)BENZYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
C=CCN1C(=O)C(=CC2=CC=C(C=C2)OCC3=CC=C(C=C3)Cl)C(=O)NC1=S
C=CCN1C(=S)NC(=O)C(=Cc2ccc(cc2)OCc2ccc(cc2)Cl)C1=O
InChI=1SC21H17ClN2O3Sc12112420(26)18(19(25)2321(24)28)12145917(10614)2713153716(22)8415h21012H11113H2(H232528)b1812+
MFCD03699175
ZINC000000683804
ZINC00683804
ZINC683804
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