Vitas-M small molecule compound

dimethyl 2,2'-[(1,6-dioxohexane-1,6-diyl)diimino]bis(5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate)

Catalog ID
STK098362
SMILES COC(=O)c1c(NC(=O)CCCCC(=O)Nc2sc3c(c2C(=O)OC)CCC3)sc2c1CCC2

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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 C24H28N2O6S2 MW 504.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N2O6S2/c1-31-23(29)19-13-7-5-9-15(13)33-21(19)25-17(27)11-3-4-12-18(28)26-22-20(24(30)32-2)14-8-6-10-16(14)34-22/h3-12H2,1-2H3,(H,25,27)(H,26,28)
InChIKey
MHGCACNARSBZHG-UHFFFAOYSA-N
Synonyms

COC(=O)C1=C(SC2=C1CCC2)NC(=O)CCCCC(=O)NC3=C(C4=C(S3)CCC4)C(=O)OC
COC(=O)c1c(NC(=O)CCCCC(=O)Nc2sc3c(c2C(=O)OC)CCC3)sc2c1CCC2
DIMETHYL22((16DIOXOHEXANE16DIYL)DIIMINO)BIS(56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE)
InChI=1SC24H28N2O6S2c13123(29)191375915(13)3321(19)2517(27)11341218(28)262220(24(30)322)14861016(14)3422h312H212H3(H2527)(H2628)
METHYL2((6((3(METHOXYCARBONYL)56DIHYDRO4HCYCLOPENTA(B)THIEN2YL)AMINO)6OXOHEXANOYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
METHYL2((6((3METHOXYCARBONYL56DIHYDRO4HCYCLOPENTA(B)THIOPHEN2YL)AMINO)6OXOHEXANOYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
MFCD01119869
STK098362
ZINC000006879007
ZINC06879007
ZINC6879007

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Available files

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