Vitas-M small molecule compound

2-{1-(4-chlorophenyl)-3-[3-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)propyl]-5-oxo-2-thioxoimidazolidin-4-yl}-N-(4-propoxyphenyl)acetamide

Catalog ID
STK027850
SMILES CCCOc1ccc(cc1)NC(=O)CC1N(CCCn2nc(c(c2C)[N+](=O)[O-])C)C(=S)N(C1=O)c1ccc(cc1)Cl

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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 C28H31ClN6O5S MW 599.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31ClN6O5S/c1-4-16-40-23-12-8-21(9-13-23)30-25(36)17-24-27(37)34(22-10-6-20(29)7-11-22)28(41)32(24)14-5-15-33-19(3)26(35(38)39)18(2)31-33/h6-13,24H,4-5,14-17H2,1-3H3,(H,30,36)
InChIKey
ORDYVULANLLFIU-UHFFFAOYSA-N
Synonyms
1025019-21-9
1025019219
2(1(4CHLOROPHENYL)3(3(35DIMETHYL4NITRO1HPYRAZOL1YL)PROPYL)5OXO2THIOXOIMIDAZOLIDIN4YL)N(4PROPOXYPHENYL)ACETAMIDE
2(1(4CHLOROPHENYL)3(3(35DIMETHYL4NITROPYRAZOL1YL)PROPYL)5OXO2SULFANYLIDENEIMIDAZOLIDIN4YL)N(4PROPOXYPHENYL)ACETAMIDE
CCCOC1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CCCN3C(=C(C(=N3)C)(N+)(=O)(O))C)C4=CC=C(C=C4)Cl
CCCOc1ccc(cc1)NC(=O)CC1N(CCCn2nc(c(c2C)(N+)(=O)(O))C)C(=S)N(C1=O)c1ccc(cc1)Cl
InChI=1SC28H31ClN6O5Sc1416402312821(91323)3025(36)172427(37)34(2210620(29)71122)28(41)32(24)145153319(3)26(35(38)39)18(2)3133h61324H451417H213H3(H3036)
MFCD03487342
STK027850
ZINC000097948722
ZINC000097948723

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Available files

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