Vitas-M small molecule compound
methyl 5-(diethylcarbamoyl)-2-[(2,3-dihydro-1H-inden-5-ylcarbamothioyl)amino]-4-methylthiophene-3-carboxylate
Catalog ID
STK456221
SMILES CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=S)Nc1ccc2c(c1)CCC2)CC
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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 C22H27N3O3S2 MW 445.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N3O3S2/c1-5-25(6-2)20(26)18-13(3)17(21(27)28-4)19(30-18)24-22(29)23-16-11-10-14-8-7-9-15(14)12-16/h10-12H,5-9H2,1-4H3,(H2,23,24,29)InChIKey
HFQBVSYKOAWRJE-UHFFFAOYSA-NSynonyms
CCN(CC)C(=O)C1=C(C(=C(S1)NC(=S)NC2=CC3=C(CCC3)C=C2)C(=O)OC)C
InChI=1SC22H27N3O3S2c1525(62)20(26)1813(3)17(21(27)284)19(3018)2422(29)231611101487915(14)1216h1012H59H214H3(H2232429)
methyl5(diethylcarbamoyl)2((23dihydro1Hinden5ylcarbamothioyl)amino)4methylthiophene3carboxylate
METHYL5(DIETHYLCARBAMOYL)2(23DIHYDRO1HINDEN5YLCARBAMOTHIOYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
METHYL5(NNDIETHYLCARBAMOYL)2(((INDAN5YLAMINO)THIOXOMETHYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
MFCD05060235
ZINC000002855834
ZINC02855834
ZINC2855834
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