Vitas-M small molecule compound
dimethyl 2-{[(4'-carbamoyl-1,4'-bipiperidin-1'-yl)carbonothioyl]amino}benzene-1,4-dicarboxylate
Catalog ID
STK206923
SMILES COC(=O)c1ccc(cc1NC(=S)N1CCC(CC1)(C(=O)N)N1CCCCC1)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 C22H30N4O5S MW 462.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N4O5S/c1-30-18(27)15-6-7-16(19(28)31-2)17(14-15)24-21(32)25-12-8-22(9-13-25,20(23)29)26-10-4-3-5-11-26/h6-7,14H,3-5,8-13H2,1-2H3,(H2,23,29)(H,24,32)InChIKey
CNEDVJAJUANQSQ-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=S)N2CCC(CC2)(C(=O)N)N3CCCCC3
DIMETHYL2(((4CARBAMOYL14BIPIPERIDIN1YL)CARBONOTHIOYL)AMINO)BENZENE14DICARBOXYLATE
dimethyl2((4carbamoyl4piperidin1ylpiperidine1carbothioyl)amino)benzene14dicarboxylate
InChI=1SC22H30N4O5Sc13018(27)156716(19(28)312)17(1415)2421(32)2512822(9132520(23)29)26104351126h6714H35813H212H3(H22329)(H2432)
METHYL3(((4CARBAMOYL4PIPERIDYLPIPERIDYL)THIOXOMETHYL)AMINO)4(METHOXYCARBONYL)BENZOATE
MFCD06150122
ZINC000004574430
ZINC4574430
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