Vitas-M small molecule compound
5-{[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]methylidene}-1,3-bis(2-methylphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK534648
SMILES Cc1ccccc1N1C(=O)/C(=C/Nc2c(C)n(n(c2=O)c2ccccc2)C)/C(=O)N(C1=S)c1ccccc1C
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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 C30H27N5O3S MW 537.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27N5O3S/c1-19-12-8-10-16-24(19)33-27(36)23(28(37)34(30(33)39)25-17-11-9-13-20(25)2)18-31-26-21(3)32(4)35(29(26)38)22-14-6-5-7-15-22/h5-18,31H,1-4H3InChIKey
XZKQOHVSPZHVEZ-UHFFFAOYSA-NSynonyms
5(((15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)amino)methylene)2thioxo13diotolyldihydropyrimidine46(1H5H)dione
5(((15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)amino)methylidene)13bis(2methylphenyl)2thioxodihydropyrimidine46(1H5H)dione
5(((15DIMETHYL3OXO2PHENYLPYRAZOL4YL)AMINO)METHYLIDENE)13BIS(2METHYLPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
CC1=CC=CC=C1N2C(=O)C(=CNC3=C(N(N(C3=O)C4=CC=CC=C4)C)C)C(=O)N(C2=S)C5=CC=CC=C5C
Cc1ccccc1N1C(=O)C(=CNc2c(C)n(n(c2=O)c2ccccc2)C)C(=O)N(C1=S)c1ccccc1C
InChI=1SC30H27N5O3Sc119128101624(19)3327(36)23(28(37)34(30(33)39)25171191320(25)2)18312621(3)32(4)35(29(26)38)22146571522h51831H14H3
MFCD02990142
ZINC000002262353
ZINC2262353
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.