Vitas-M small molecule compound
dimethyl 2-({[4-(pyrimidin-2-yl)piperazin-1-yl]carbonothioyl}amino)benzene-1,4-dicarboxylate
Catalog ID
STK262650
SMILES COC(=O)c1ccc(cc1NC(=S)N1CCN(CC1)c1ncccn1)C(=O)OC
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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 C19H21N5O4S MW 415.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N5O4S/c1-27-16(25)13-4-5-14(17(26)28-2)15(12-13)22-19(29)24-10-8-23(9-11-24)18-20-6-3-7-21-18/h3-7,12H,8-11H2,1-2H3,(H,22,29)InChIKey
WWGUELJQWQIEJY-UHFFFAOYSA-NSynonyms
895993-92-7895993927
COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=S)N2CCN(CC2)C3=NC=CC=N3
dimethyl2(((4(pyrimidin2yl)piperazin1yl)carbonothioyl)amino)benzene14dicarboxylate
DIMETHYL2((4PYRIMIDIN2YLPIPERAZINE1CARBOTHIOYL)AMINO)BENZENE14DICARBOXYLATE
dimethyl2(4(pyrimidin2yl)piperazine1carbothioamido)terephthalate
InChI=1SC19H21N5O4Sc12716(25)134514(17(26)282)15(1213)2219(29)2410823(91124)18206372118h3712H811H212H3(H2229)
METHYL4(METHOXYCARBONYL)3(((4PYRIMIDIN2YLPIPERAZINYL)THIOXOMETHYL)AMINO)BENZOATE
MFCD06601014
ZINC000002227106
ZINC02227106
ZINC2227106
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