Vitas-M small molecule compound
dimethyl 2-({[3-(hydroxymethyl)piperidin-1-yl]carbonothioyl}amino)benzene-1,4-dicarboxylate
Catalog ID
STK206953
SMILES OCC1CCCN(C1)C(=S)Nc1cc(ccc1C(=O)OC)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 C17H22N2O5S MW 366.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2O5S/c1-23-15(21)12-5-6-13(16(22)24-2)14(8-12)18-17(25)19-7-3-4-11(9-19)10-20/h5-6,8,11,20H,3-4,7,9-10H2,1-2H3,(H,18,25)InChIKey
BBTZNPGKJLSFKJ-UHFFFAOYSA-NSynonyms
830353-69-0830353690
COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=S)N2CCCC(C2)CO
DIMETHYL2(((3(HYDROXYMETHYL)1PIPERIDINYL)CARBONOTHIOYL)AMINO)TEREPHTHALATE
DIMETHYL2(((3(HYDROXYMETHYL)PIPERIDIN1YL)CARBONOTHIOYL)AMINO)BENZENE14DICARBOXYLATE
DIMETHYL2((3(HYDROXYMETHYL)PIPERIDINE1CARBOTHIOYL)AMINO)BENZENE14DICARBOXYLATE
dimethyl2(3(hydroxymethyl)piperidine1carbothioamido)terephthalate
InChI=1SC17H22N2O5Sc12315(21)125613(16(22)242)14(812)1817(25)1973411(919)1020h5681120H347910H212H3(H1825)
METHYL3(((3(HYDROXYMETHYL)PIPERIDYL)THIOXOMETHYL)AMINO)4(METHOXYCARBONYL)BENZOATE
MFCD06150170
ZINC000002433460
ZINC000002433462
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