Vitas-M small molecule compound

methyl (2Z)-5-(2-methylpropyl)-2-({[1-methyl-3-(thiophen-2-yl)-1H-pyrazol-5-yl]carbonyl}imino)-2,3-dihydro-1,3-thiazole-4-carboxylate

Catalog ID
STL317807
SMILES COC(=O)c1[nH]/c(=N/C(=O)c2cc(nn2C)c2cccs2)/sc1CC(C)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 C18H20N4O3S2 MW 404.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O3S2/c1-10(2)8-14-15(17(24)25-4)19-18(27-14)20-16(23)12-9-11(21-22(12)3)13-6-5-7-26-13/h5-7,9-10H,8H2,1-4H3,(H,19,20,23)
InChIKey
BGSSWCOQDMZRGV-UHFFFAOYSA-N
Synonyms
1401602-31-0
1401602310
CC(C)CC1=C(N=C(S1)NC(=O)C2=CC(=NN2C)C3=CC=CS3)C(=O)OC
COC(=O)c1(nH)c(=NC(=O)c2cc(nn2C)c2cccs2)sc1CC(C)C
InChI=1SC18H20N4O3S2c110(2)81415(17(24)254)1918(2714)2016(23)12911(2122(12)3)136572613h57910H8H214H3(H192023)
methyl(2Z)5(2methylpropyl)2(((1methyl3(thiophen2yl)1Hpyrazol5yl)carbonyl)imino)23dihydro13thiazole4carboxylate
methyl5(2methylpropyl)2((2methyl5thiophen2ylpyrazole3carbonyl)amino)13thiazole4carboxylate
MFCD28030924
ZINC000079480471
ZINC79480471

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Available files

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