Vitas-M small molecule compound
methyl (2Z)-5-(2-phenylethyl)-2-[(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-ylcarbonyl)imino]-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL320297
SMILES COC(=O)c1[nH]/c(=N/C(=O)c2n[nH]c3c2CCC3)/sc1CCc1ccccc1
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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 C20H20N4O3S MW 396.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O3S/c1-27-19(26)17-15(11-10-12-6-3-2-4-7-12)28-20(21-17)22-18(25)16-13-8-5-9-14(13)23-24-16/h2-4,6-7H,5,8-11H2,1H3,(H,23,24)(H,21,22,25)InChIKey
YCHYRBAYJDEKCA-UHFFFAOYSA-NSynonyms
1442084-99-21442084992
COC(=O)c1(nH)c(=NC(=O)c2n(nH)c3c2CCC3)sc1CCc1ccccc1
methyl(2Z)5(2phenylethyl)2((1456tetrahydrocyclopenta(c)pyrazol3ylcarbonyl)imino)23dihydro13thiazole4carboxylate
MFCD28029418
ZINC000095480708
ZINC95480708
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