Vitas-M small molecule compound

2-({[4-(ethoxycarbonyl)piperazin-1-yl](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid

Catalog ID
STK605103
SMILES CCOC(=O)N1CCN(CC1)C(=O)C(=O)Nc1sc2c(c1C(=O)O)CC(OC2)(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 C19H25N3O7S MW 439.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H25N3O7S/c1-4-28-18(27)22-7-5-21(6-8-22)16(24)14(23)20-15-13(17(25)26)11-9-19(2,3)29-10-12(11)30-15/h4-10H2,1-3H3,(H,20,23)(H,25,26)
InChIKey
KOFRNRJMKWZBMR-UHFFFAOYSA-N
Synonyms
903202-85-7
2(((4(ethoxycarbonyl)piperazin1yl)(oxo)acetyl)amino)55dimethyl47dihydro5Hthieno(23c)pyran3carboxylicacid
2((2(4ethoxycarbonylpiperazin1yl)2oxoacetyl)amino)55dimethyl47dihydrothieno(23c)pyran3carboxylicacid
2(2(4(ethoxycarbonyl)piperazin1yl)2oxoacetamido)55dimethyl57dihydro4Hthieno(23c)pyran3carboxylicacid
903202857
CCOC(=O)N1CCN(CC1)C(=O)C(=O)NC2=C(C3=C(S2)COC(C3)(C)C)C(=O)O
InChI=1SC19H25N3O7Sc142818(27)227521(6822)16(24)14(23)201513(17(25)26)11919(23)291012(11)3015h410H213H3(H2023)(H2526)
MFCD08291559
ZINC000009435424
ZINC9435424

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Available files

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