Vitas-M small molecule compound
5-{[(1,3-dihydroxy-2-methylpropan-2-yl)amino]methylidene}-1,3-bis(2-methylphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK837551
SMILES OCC(N/C=C/1\C(=O)N(c2ccccc2C)C(=S)N(C1=O)c1ccccc1C)(CO)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 C23H25N3O4S MW 439.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N3O4S/c1-15-8-4-6-10-18(15)25-20(29)17(12-24-23(3,13-27)14-28)21(30)26(22(25)31)19-11-7-5-9-16(19)2/h4-12,24,27-28H,13-14H2,1-3H3InChIKey
PVSWCCIABZRVEF-UHFFFAOYSA-NSynonyms
5(((13dihydroxy2methylpropan2yl)amino)methylene)2thioxo13diotolyldihydropyrimidine46(1H5H)dione
5(((13DIHYDROXY2METHYLPROPAN2YL)AMINO)METHYLIDENE)13BIS(2METHYLPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
5(((13dihydroxy2methylpropan2yl)amino)methylidene)13bis(2methylphenyl)2thioxodihydropyrimidine46(1H5H)dione
CC1=CC=CC=C1N2C(=O)C(=CNC(C)(CO)CO)C(=O)N(C2=S)C3=CC=CC=C3C
InChI=1SC23H25N3O4Sc1158461018(15)2520(29)17(122423(31327)1428)21(30)26(22(25)31)191175916(19)2h412242728H1314H213H3
MFCD00576403
OCC(NC=C1C(=O)N(c2ccccc2C)C(=S)N(C1=O)c1ccccc1C)(CO)C
ZINC000002301626
ZINC02301626
ZINC2301626
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