Vitas-M small molecule compound
(5E)-5-{4-[(4-methylbenzyl)oxy]benzylidene}-1-(prop-2-en-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK187415
SMILES C=CCN1C(=S)NC(=O)/C(=C\c2ccc(cc2)OCc2ccc(cc2)C)/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 C22H20N2O3S MW 392.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O3S/c1-3-12-24-21(26)19(20(25)23-22(24)28)13-16-8-10-18(11-9-16)27-14-17-6-4-15(2)5-7-17/h3-11,13H,1,12,14H2,2H3,(H,23,25,28)/b19-13+InChIKey
KSOXRBREZHUFRQ-CPNJWEJPSA-NSynonyms
(5E)5((4((4METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)1PROP2ENYL2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5(4((4METHYLBENZYL)OXY)BENZYLIDENE)1(PROP2EN1YL)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
C=CCN1C(=S)NC(=O)C(=Cc2ccc(cc2)OCc2ccc(cc2)C)C1=O
CC1=CC=C(C=C1)COC2=CC=C(C=C2)C=C3C(=O)NC(=S)N(C3=O)CC=C
InChI=1SC22H20N2O3Sc13122421(26)19(20(25)2322(24)28)131681018(11916)2714176415(2)5717h31113H11214H22H3(H232528)b1913+
MFCD03707062
ZINC000001153443
ZINC01153443
ZINC1153443
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