Vitas-M small molecule compound
ethyl (2Z)-4-methyl-2-({[4-phenyl-2-(1H-pyrrol-1-yl)-1,3-thiazol-5-yl]carbonyl}imino)-2,3-dihydro-1,3-thiazole-5-carboxylate
Catalog ID
STL161331
SMILES CCOC(=O)c1s/c(=N\C(=O)c2sc(nc2c2ccccc2)n2cccc2)/[nH]c1C
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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 C21H18N4O3S2 MW 438.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O3S2/c1-3-28-19(27)16-13(2)22-20(29-16)24-18(26)17-15(14-9-5-4-6-10-14)23-21(30-17)25-11-7-8-12-25/h4-12H,3H2,1-2H3,(H,22,24,26)InChIKey
PWSFOCWHMVISMF-UHFFFAOYSA-NSynonyms
1282114-73-11282114731
CCOC(=O)C1=C(N=C(S1)NC(=O)C2=C(N=C(S2)N3C=CC=C3)C4=CC=CC=C4)C
CCOC(=O)c1sc(=NC(=O)c2sc(nc2c2ccccc2)n2cccc2)(nH)c1C
ethyl(2Z)4methyl2(((4phenyl2(1Hpyrrol1yl)13thiazol5yl)carbonyl)imino)23dihydro13thiazole5carboxylate
ethyl4methyl2((4phenyl2pyrrol1yl13thiazole5carbonyl)amino)13thiazole5carboxylate
InChI=1SC21H18N4O3S2c132819(27)1613(2)2220(2916)2418(26)1715(1495461014)2321(3017)2511781225h412H3H212H3(H222426)
MFCD20759344
ZINC000061720151
ZINC61720151
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