Vitas-M small molecule compound
(2E)-2-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methylidene]-5-(4-hydroxy-3-methoxyphenyl)-7-methyl-3-oxo-N-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Catalog ID
STL403108
SMILES COc1cc(ccc1O)C1C(=C(C)N=c2n1c(=O)/c(=C\c1cn(nc1C)CC)/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/c1-5-32-15-19(16(2)31-32)14-23-27(36)33-25(18-11-12-21(34)22(13-18)37-4)24(17(3)29-28(33)38-23)26(35)30-20-9-7-6-8-10-20/h6-15,25,34H,5H2,1-4H3,(H,30,35)/b23-14+InChIKey
TZIXNOWXLXWKTG-OEAKJJBVSA-NSynonyms
1005659-97-1(2E)2((1ethyl3methyl1Hpyrazol4yl)methylidene)5(4hydroxy3methoxyphenyl)7methyl3oxoNphenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxamide
(2E)2((1ETHYL3METHYLPYRAZOL4YL)METHYLIDENE)5(4HYDROXY3METHOXYPHENYL)7METHYL3OXONPHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXAMIDE
1005659971
CCN1C=C(C(=N1)C)C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)NC4=CC=CC=C4)C5=CC(=C(C=C5)O)OC
COc1cc(ccc1O)C1C(=C(C)N=c2n1c(=O)c(=Cc1cn(nc1C)CC)s2)C(=O)Nc1ccccc1
InChI=1SC28H27N5O4Sc15321519(16(2)3132)142327(36)3325(18111221(34)22(1318)374)24(17(3)2928(33)3823)26(35)302097681020h6152534H5H214H3(H3035)b2314+
MFCD04050217
ZINC000097945504
ZINC000097945505
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