Vitas-M small molecule compound

dimethyl 5-({[1-(2,5-dimethoxyphenyl)ethyl]carbamothioyl}amino)-3-methylthiophene-2,4-dicarboxylate

Catalog ID
STK456853
SMILES COc1ccc(c(c1)C(NC(=S)Nc1sc(c(c1C(=O)OC)C)C(=O)OC)C)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 C20H24N2O6S2 MW 452.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N2O6S2/c1-10-15(18(23)27-5)17(30-16(10)19(24)28-6)22-20(29)21-11(2)13-9-12(25-3)7-8-14(13)26-4/h7-9,11H,1-6H3,(H2,21,22,29)
InChIKey
AKYYNAULCONPMR-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=C1C(=O)OC)NC(=S)NC(C)C2=C(C=CC(=C2)OC)OC)C(=O)OC
DIMETHYL5((((1R)1(25DIMETHOXYPHENYL)ETHYL)CARBAMOTHIOYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
DIMETHYL5((((1S)1(25DIMETHOXYPHENYL)ETHYL)CARBAMOTHIOYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
dimethyl5(((1(25dimethoxyphenyl)ethyl)carbamothioyl)amino)3methylthiophene24dicarboxylate
DIMETHYL5(1(25DIMETHOXYPHENYL)ETHYLCARBAMOTHIOYLAMINO)3METHYLTHIOPHENE24DICARBOXYLATE
InChI=1SC20H24N2O6S2c11015(18(23)275)17(3016(10)19(24)286)2220(29)2111(2)13912(253)7814(13)264h7911H16H3(H2212229)
METHYL2(((((25DIMETHOXYPHENYL)ETHYL)AMINO)THIOXOMETHYL)AMINO)5(METHOXYCARBONYL)4METHYLTHIOPHENE3CARBOXYLATE
MFCD04220320
ZINC000002853997
ZINC000002853998

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.