Vitas-M small molecule compound
diethyl 5-{[(2-phenylethyl)carbamothioyl]amino}benzene-1,3-dicarboxylate
Catalog ID
STL178555
SMILES CCOC(=O)c1cc(NC(=S)NCCc2ccccc2)cc(c1)C(=O)OCC
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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 C21H24N2O4S MW 400.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O4S/c1-3-26-19(24)16-12-17(20(25)27-4-2)14-18(13-16)23-21(28)22-11-10-15-8-6-5-7-9-15/h5-9,12-14H,3-4,10-11H2,1-2H3,(H2,22,23,28)InChIKey
ZESDMZYGSXUQCL-UHFFFAOYSA-NSynonyms
832144-89-5832144895
CCOC(=O)C1=CC(=CC(=C1)NC(=S)NCCC2=CC=CC=C2)C(=O)OCC
diethyl5(((2phenylethyl)carbamothioyl)amino)benzene13dicarboxylate
diethyl5(2phenylethylcarbamothioylamino)benzene13dicarboxylate
InChI=1SC21H24N2O4Sc132619(24)161217(20(25)2742)1418(1316)2321(28)221110158657915h591214H341011H212H3(H2222328)
MFCD05667062
ZINC000002809086
ZINC02809086
ZINC2809086
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