Vitas-M small molecule compound
dimethyl 5-{[(4'-carbamoyl-1,4'-bipiperidin-1'-yl)carbonothioyl]amino}benzene-1,3-dicarboxylate
Catalog ID
STK164917
SMILES COC(=O)c1cc(NC(=S)N2CCC(CC2)(N2CCCCC2)C(=O)N)cc(c1)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)15-12-16(19(28)31-2)14-17(13-15)24-21(32)25-10-6-22(7-11-25,20(23)29)26-8-4-3-5-9-26/h12-14H,3-11H2,1-2H3,(H2,23,29)(H,24,32)InChIKey
HWXSUMKTBVAMNO-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC(=CC(=C1)NC(=S)N2CCC(CC2)(C(=O)N)N3CCCCC3)C(=O)OC
DIMETHYL5(((4CARBAMOYL14BIPIPERIDIN1YL)CARBONOTHIOYL)AMINO)BENZENE13DICARBOXYLATE
DIMETHYL5((4CARBAMOYL4PIPERIDIN1YLPIPERIDINE1CARBOTHIOYL)AMINO)BENZENE13DICARBOXYLATE
InChI=1SC22H30N4O5Sc13018(27)151216(19(28)312)1417(1315)2421(32)2510622(7112520(23)29)268435926h1214H311H212H3(H22329)(H2432)
METHYL5(((4CARBAMOYL4PIPERIDYLPIPERIDYL)THIOXOMETHYL)AMINO)3(METHOXYCARBONYL)BENZOATE
MFCD05993935
ZINC000009846588
ZINC9846588
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