Vitas-M small molecule compound
5-(4-methoxybenzylidene)-1,3-bis(4-methylphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL484664
SMILES COc1ccc(cc1)/C=C/1\C(=O)N(c2ccc(cc2)C)C(=S)N(C1=O)c1ccc(cc1)C
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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 C26H22N2O3S MW 442.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N2O3S/c1-17-4-10-20(11-5-17)27-24(29)23(16-19-8-14-22(31-3)15-9-19)25(30)28(26(27)32)21-12-6-18(2)7-13-21/h4-16H,1-3H3InChIKey
POPIZHNGXHPPQE-UHFFFAOYSA-NSynonyms
5((4METHOXYPHENYL)METHYLIDENE)13BIS(4METHYLPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
5(4METHOXYBENZYLIDENE)13BIS(4METHYLPHENYL)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
CC1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(C=C3)OC)C(=O)N(C2=S)C4=CC=C(C=C4)C
COc1ccc(cc1)C=C1C(=O)N(c2ccc(cc2)C)C(=S)N(C1=O)c1ccc(cc1)C
InChI=1SC26H22N2O3Sc11741020(11517)2724(29)23(161981422(313)15919)25(30)28(26(27)32)2112618(2)71321h416H13H3
MFCD01442545
ZINC000001205941
ZINC01205941
ZINC1205941
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