Vitas-M small molecule compound

dimethyl 2,2'-[(2,2,3,3,4,4,5,5-octafluoro-1,6-dioxohexane-1,6-diyl)diimino]bis(4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate)

Catalog ID
STK425045
SMILES COC(=O)c1c(sc2c1CCCCCC2)NC(=O)C(C(C(C(C(=O)Nc1sc2c(c1C(=O)OC)CCCCCC2)(F)F)(F)F)(F)F)(F)F

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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 C30H32F8N2O6S2 MW 732.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32F8N2O6S2/c1-45-23(41)19-15-11-7-3-5-9-13-17(15)47-21(19)39-25(43)27(31,32)29(35,36)30(37,38)28(33,34)26(44)40-22-20(24(42)46-2)16-12-8-4-6-10-14-18(16)48-22/h3-14H2,1-2H3,(H,39,43)(H,40,44)
InChIKey
RFWWWFFBTSZJAE-UHFFFAOYSA-N
Synonyms

COC(=O)C1=C(SC2=C1CCCCCC2)NC(=O)C(C(C(C(C(=O)NC3=C(C4=C(S3)CCCCCC4)C(=O)OC)(F)F)(F)F)(F)F)(F)F
dimethyl22((22334455octafluoro16dioxohexane16diyl)diimino)bis(456789hexahydrocycloocta(b)thiophene3carboxylate)
InChI=1SC30H32F8N2O6S2c14523(41)19151173591317(15)4721(19)3925(43)27(3132)29(3536)30(3738)28(3334)26(44)402220(24(42)462)1612846101418(16)4822h314H212H3(H3943)(H4044)
methyl2((22334455octafluoro6((3methoxycarbonyl456789hexahydrocycloocta(b)thiophen2yl)amino)6oxohexanoyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
MFCD02334675
ZINC000008398417
ZINC08398417
ZINC8398417

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Available files

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