Vitas-M small molecule compound
methyl (2E)-2-({[2-methyl-4-(propan-2-yl)-1,3-thiazol-5-yl]carbonyl}imino)-5-(2-phenylethyl)-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL411011
SMILES COC(=O)c1[nH]/c(=N\C(=O)c2sc(nc2C(C)C)C)/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 C21H23N3O3S2 MW 429.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O3S2/c1-12(2)16-18(28-13(3)22-16)19(25)24-21-23-17(20(26)27-4)15(29-21)11-10-14-8-6-5-7-9-14/h5-9,12H,10-11H2,1-4H3,(H,23,24,25)InChIKey
ADEPRQYLYAVDQP-UHFFFAOYSA-NSynonyms
1574294-23-71574294237
CC1=NC(=C(S1)C(=O)NC2=NC(=C(S2)CCC3=CC=CC=C3)C(=O)OC)C(C)C
COC(=O)c1(nH)c(=NC(=O)c2sc(nc2C(C)C)C)sc1CCc1ccccc1
InChI=1SC21H23N3O3S2c112(2)1618(2813(3)2216)19(25)24212317(20(26)274)15(2921)1110148657914h5912H1011H214H3(H232425)
methyl(2E)2(((2methyl4(propan2yl)13thiazol5yl)carbonyl)imino)5(2phenylethyl)23dihydro13thiazole4carboxylate
methyl2((2methyl4propan2yl13thiazole5carbonyl)amino)5(2phenylethyl)13thiazole4carboxylate
MFCD30706495
ZINC000096230739
ZINC96230739
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