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-methoxyphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK548480
SMILES COc1ccccc1N1C(=O)/C(=C/Nc2c(C)n(n(c2=O)c2ccccc2)C)/C(=O)N(C1=S)c1ccccc1OC
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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 C30H27N5O5S MW 569.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27N5O5S/c1-19-26(29(38)35(32(19)2)20-12-6-5-7-13-20)31-18-21-27(36)33(22-14-8-10-16-24(22)39-3)30(41)34(28(21)37)23-15-9-11-17-25(23)40-4/h5-18,31H,1-4H3InChIKey
PTXOLLXYPMOHPO-UHFFFAOYSA-NSynonyms
5(((15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)amino)methylene)13bis(2methoxyphenyl)2thioxodihydropyrimidine46(1H5H)dione
5(((15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)amino)methylidene)13bis(2methoxyphenyl)2thioxodihydropyrimidine46(1H5H)dione
5(((15DIMETHYL3OXO2PHENYLPYRAZOL4YL)AMINO)METHYLIDENE)13BIS(2METHOXYPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC=C3C(=O)N(C(=S)N(C3=O)C4=CC=CC=C4OC)C5=CC=CC=C5OC
COc1ccccc1N1C(=O)C(=CNc2c(C)n(n(c2=O)c2ccccc2)C)C(=O)N(C1=S)c1ccccc1OC
InChI=1SC30H27N5O5Sc11926(29(38)35(32(19)2)20126571320)31182127(36)33(22148101624(22)393)30(41)34(28(21)37)23159111725(23)404h51831H14H3
MFCD02988009
ZINC000102450865
ZINC102450865
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.