Vitas-M small molecule compound
(5E)-5-{3-ethoxy-4-[(3-methylbenzyl)oxy]benzylidene}-1-(prop-2-en-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK190177
SMILES C=CCN1C(=S)NC(=O)/C(=C\c2ccc(c(c2)OCC)OCc2cccc(c2)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 C24H24N2O4S MW 436.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N2O4S/c1-4-11-26-23(28)19(22(27)25-24(26)31)13-17-9-10-20(21(14-17)29-5-2)30-15-18-8-6-7-16(3)12-18/h4,6-10,12-14H,1,5,11,15H2,2-3H3,(H,25,27,31)/b19-13+InChIKey
VJIOPBGXFRELRM-CPNJWEJPSA-NSynonyms
(5E)5((3ethoxy4((3methylphenyl)methoxy)phenyl)methylidene)1prop2enyl2sulfanylidene13diazinane46dione
(5E)5(3ETHOXY4((3METHYLBENZYL)OXY)BENZYLIDENE)1(PROP2EN1YL)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
C=CCN1C(=S)NC(=O)C(=Cc2ccc(c(c2)OCC)OCc2cccc(c2)C)C1=O
CCOC1=C(C=CC(=C1)C=C2C(=O)NC(=S)N(C2=O)CC=C)OCC3=CC=CC(=C3)C
InChI=1SC24H24N2O4Sc14112623(28)19(22(27)2524(26)31)131791020(21(1417)2952)30151886716(3)1218h46101214H151115H223H3(H252731)b1913+
MFCD04580154
ZINC000009260154
ZINC09260154
ZINC9260154
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