Vitas-M small molecule compound
dimethyl 2,2'-[(1,5-dioxopentane-1,5-diyl)diimino]bis(4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate)
Catalog ID
STK418333
SMILES COC(=O)c1c(NC(=O)CCCC(=O)Nc2sc3c(c2C(=O)OC)CCCCCC3)sc2c1CCCCCC2
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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 C29H38N2O6S2 MW 574.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H38N2O6S2/c1-36-28(34)24-18-12-7-3-5-9-14-20(18)38-26(24)30-22(32)16-11-17-23(33)31-27-25(29(35)37-2)19-13-8-4-6-10-15-21(19)39-27/h3-17H2,1-2H3,(H,30,32)(H,31,33)InChIKey
FOXIDORLJFTCST-UHFFFAOYSA-NSynonyms
354547-49-2354547492
COC(=O)C1=C(SC2=C1CCCCCC2)NC(=O)CCCC(=O)NC3=C(C4=C(S3)CCCCCC4)C(=O)OC
dimethyl22((15dioxopentane15diyl)diimino)bis(456789hexahydrocycloocta(b)thiophene3carboxylate)
InChI=1SC29H38N2O6S2c13628(34)24181273591420(18)3826(24)3022(32)16111723(33)312725(29(35)372)1913846101521(19)3927h317H212H3(H3032)(H3133)
methyl2((5((3methoxycarbonyl456789hexahydrocycloocta(b)thiophen2yl)amino)5oxopentanoyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
MFCD01835628
ZINC000002096010
ZINC02096010
ZINC2096010
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