Vitas-M small molecule compound

2-[(5-ethoxy-1H-benzimidazol-2-yl)sulfanyl]-1-{3-[(4-methylphenyl)sulfonyl]imidazolidin-1-yl}ethanone

Catalog ID
STK226621
SMILES CCOc1ccc2c(c1)nc([nH]2)SCC(=O)N1CCN(C1)S(=O)(=O)c1ccc(cc1)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 C21H24N4O4S2 MW 460.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O4S2/c1-3-29-16-6-9-18-19(12-16)23-21(22-18)30-13-20(26)24-10-11-25(14-24)31(27,28)17-7-4-15(2)5-8-17/h4-9,12H,3,10-11,13-14H2,1-2H3,(H,22,23)
InChIKey
OHLMROWHSNMTIQ-UHFFFAOYSA-N
Synonyms
832745-92-3
2((5ethoxy1Hbenzimidazol2yl)sulfanyl)1(3((4methylphenyl)sulfonyl)imidazolidin1yl)ethanone
2((6ETHOXY1HBENZIMIDAZOL2YL)SULFANYL)1(3(4METHYLPHENYL)SULFONYLIMIDAZOLIDIN1YL)ETHANONE
6ETHOXY2((2(3((4METHYLPHENYL)SULFONYL)IMIDAZOLIDIN1YL)2OXOETHYL)SULFANYL)1HBENZIMIDAZOLE
832745923
CCOC1=CC2=C(C=C1)N=C(N2)SCC(=O)N3CCN(C3)S(=O)(=O)C4=CC=C(C=C4)C
CCOc1ccc2c(c1)nc((nH)2)SCC(=O)N1CCN(C1)S(=O)(=O)c1ccc(cc1)C
InChI=1SC21H24N4O4S2c132916691819(1216)2321(2218)301320(26)24101125(1424)31(2728)177415(2)5817h4912H310111314H212H3(H2223)
MFCD05667600
ZINC000006150621
ZINC06150621
ZINC6150621

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Available files

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