Vitas-M small molecule compound
(2Z)-5-(4-hydroxy-3-methoxyphenyl)-7-methyl-3-oxo-N-phenyl-2-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Catalog ID
STL397585
SMILES COc1cc(ccc1O)C1C(=C(C)N=c2n1c(=O)/c(=C/c1c(C)nn(c1C)C)/s2)C(=O)Nc1ccccc1
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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 C28H27N5O4S MW 529.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N5O4S/c1-15-20(17(3)32(4)31-15)14-23-27(36)33-25(18-11-12-21(34)22(13-18)37-5)24(16(2)29-28(33)38-23)26(35)30-19-9-7-6-8-10-19/h6-14,25,34H,1-5H3,(H,30,35)/b23-14-InChIKey
WVPGHIKBLSGEBQ-UCQKPKSFSA-NSynonyms
(2Z)5(4HYDROXY3METHOXYPHENYL)7METHYL3OXONPHENYL2((135TRIMETHYL1HPYRAZOL4YL)METHYLIDENE)23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXAMIDE
(2Z)5(4hydroxy3methoxyphenyl)7methyl3oxoNphenyl2((135trimethylpyrazol4yl)methylidene)5H(13)thiazolo(32a)pyrimidine6carboxamide
CC1=C(C(N2C(=O)C(=CC3=C(N(N=C3C)C)C)SC2=N1)C4=CC(=C(C=C4)O)OC)C(=O)NC5=CC=CC=C5
COc1cc(ccc1O)C1C(=C(C)N=c2n1c(=O)c(=Cc1c(C)nn(c1C)C)s2)C(=O)Nc1ccccc1
InChI=1SC28H27N5O4Sc11520(17(3)32(4)3115)142327(36)3325(18111221(34)22(1318)375)24(16(2)2928(33)3823)26(35)301997681019h6142534H15H3(H3035)b2314
MFCD28952565
ZINC000002785487
ZINC000002785489
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.