Vitas-M small molecule compound
methyl (2Z)-5-(2-methoxyphenyl)-2-({[1-methyl-3-(thiophen-2-yl)-1H-pyrazol-5-yl]carbonyl}imino)-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL425994
SMILES COC(=O)c1[nH]/c(=N/C(=O)c2cc(nn2C)c2cccs2)/sc1c1ccccc1OC
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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 C21H18N4O4S2 MW 454.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O4S2/c1-25-14(11-13(24-25)16-9-6-10-30-16)19(26)23-21-22-17(20(27)29-3)18(31-21)12-7-4-5-8-15(12)28-2/h4-11H,1-3H3,(H,22,23,26)InChIKey
HCFLWEBISOROEG-UHFFFAOYSA-NSynonyms
1630835-10-71630835107
CN1C(=CC(=N1)C2=CC=CS2)C(=O)NC3=NC(=C(S3)C4=CC=CC=C4OC)C(=O)OC
COC(=O)c1(nH)c(=NC(=O)c2cc(nn2C)c2cccs2)sc1c1ccccc1OC
InChI=1SC21H18N4O4S2c12514(1113(2425)1696103016)19(26)23212217(20(27)293)18(3121)12745815(12)282h411H13H3(H222326)
methyl(2Z)5(2methoxyphenyl)2(((1methyl3(thiophen2yl)1Hpyrazol5yl)carbonyl)imino)23dihydro13thiazole4carboxylate
methyl5(2methoxyphenyl)2((2methyl5thiophen2ylpyrazole3carbonyl)amino)13thiazole4carboxylate
MFCD30710304
ZINC000170622214
ZINC170622214
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