Vitas-M small molecule compound

methyl 2-{[(2,4-dimethylphenyl)carbamothioyl]amino}-5-ethylthiophene-3-carboxylate

Catalog ID
STK438877
SMILES CCc1sc(c(c1)C(=O)OC)NC(=S)Nc1ccc(cc1C)C

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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 C17H20N2O2S2 MW 348.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N2O2S2/c1-5-12-9-13(16(20)21-4)15(23-12)19-17(22)18-14-7-6-10(2)8-11(14)3/h6-9H,5H2,1-4H3,(H2,18,19,22)
InChIKey
INUUWLHYUIUJCM-UHFFFAOYSA-N
Synonyms

CCC1=CC(=C(S1)NC(=S)NC2=C(C=C(C=C2)C)C)C(=O)OC
InChI=1SC17H20N2O2S2c1512913(16(20)214)15(2312)1917(22)18147610(2)811(14)3h69H5H214H3(H2181922)
METHYL2((((24DIMETHYLPHENYL)AMINO)THIOXOMETHYL)AMINO)5ETHYLTHIOPHENE3CARBOXYLATE
methyl2(((24dimethylphenyl)carbamothioyl)amino)5ethylthiophene3carboxylate
METHYL2((24DIMETHYLPHENYL)CARBAMOTHIOYLAMINO)5ETHYLTHIOPHENE3CARBOXYLATE
MFCD03945757
ZINC000005950072
ZINC05950072
ZINC5950072

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Available files

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