Vitas-M small molecule compound
methyl (2E)-2-({[4-(4-methoxyphenyl)-2-methyl-1,3-thiazol-5-yl]carbonyl}imino)-5-(propan-2-yl)-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL250451
SMILES COc1ccc(cc1)c1nc(sc1C(=O)/N=c/1\[nH]c(c(s1)C(C)C)C(=O)OC)C
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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 C20H21N3O4S2 MW 431.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O4S2/c1-10(2)16-15(19(25)27-5)22-20(29-16)23-18(24)17-14(21-11(3)28-17)12-6-8-13(26-4)9-7-12/h6-10H,1-5H3,(H,22,23,24)InChIKey
QSBDUSNASFKKGU-UHFFFAOYSA-NSynonyms
1351682-32-01351682320
CC1=NC(=C(S1)C(=O)NC2=NC(=C(S2)C(C)C)C(=O)OC)C3=CC=C(C=C3)OC
COc1ccc(cc1)c1nc(sc1C(=O)N=c1(nH)c(c(s1)C(C)C)C(=O)OC)C
InChI=1SC20H21N3O4S2c110(2)1615(19(25)275)2220(2916)2318(24)1714(2111(3)2817)126813(264)9712h610H15H3(H222324)
methyl(2E)2(((4(4methoxyphenyl)2methyl13thiazol5yl)carbonyl)imino)5(propan2yl)23dihydro13thiazole4carboxylate
methyl2((4(4methoxyphenyl)2methyl13thiazole5carbonyl)amino)5propan2yl13thiazole4carboxylate
MFCD24852350
ZINC000072402474
ZINC72402474
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