Vitas-M small molecule compound

ethyl 2-{[(2-phenylethyl)carbamothioyl]amino}-5-(propan-2-yl)-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate

Catalog ID
STK842102
SMILES CCOC(=O)c1c(NC(=S)NCCc2ccccc2)sc2c1CC(OC2)C(C)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 C22H28N2O3S2 MW 432.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N2O3S2/c1-4-26-21(25)19-16-12-17(14(2)3)27-13-18(16)29-20(19)24-22(28)23-11-10-15-8-6-5-7-9-15/h5-9,14,17H,4,10-13H2,1-3H3,(H2,23,24,28)
InChIKey
IDSHCXZAECMYSX-UHFFFAOYSA-N
Synonyms
497230-92-9
2(((2PHENYLETHYLAMINO)SULFANYLIDENEMETHYL)AMINO)5PROPAN2YL57DIHYDRO4HTHIENO(23C)PYRAN3CARBOXYLICACIDETHYLESTER
497230929
5ISOPROPYL2(PHENETHYLTHIOCARBAMOYLAMINO)57DIHYDRO4HTHIENO(23C)PYRAN3CARBOXYLICACIDETHYLESTER
CCOC(=O)C1=C(SC2=C1CC(OC2)C(C)C)NC(=S)NCCC3=CC=CC=C3
ethyl2(((2phenylethyl)carbamothioyl)amino)5(propan2yl)47dihydro5Hthieno(23c)pyran3carboxylate
ETHYL2(2PHENYLETHYLCARBAMOTHIOYLAMINO)5PROPAN2YL57DIHYDRO4HTHIENO(23C)PYRAN3CARBOXYLATE
ETHYL2(PHENETHYLCARBAMOTHIOYLAMINO)5PROPAN2YL57DIHYDRO4HTHIENO(23C)PYRAN3CARBOXYLATE
ETHYL5ISOPROPYL2((((2PHENYLETHYL)AMINO)CARBONOTHIOYL)AMINO)47DIHYDRO5HTHIENO(23C)PYRAN3CARBOXYLATE
ethyl5isopropyl2(3phenethylthioureido)57dihydro4Hthieno(23c)pyran3carboxylate
InChI=1SC22H28N2O3S2c142621(25)19161217(14(2)3)271318(16)2920(19)2422(28)231110158657915h591417H41013H213H3(H2232428)
MFCD03300651
ZINC000008817526
ZINC000013483372

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Available files

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