Vitas-M small molecule compound

2-{[3-(ethoxycarbonyl)-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl]carbamoyl}cyclohexanecarboxylic acid

Catalog ID
STK424317
SMILES CCOC(=O)c1c(NC(=O)C2CCCCC2C(=O)O)sc2c1CCCCCCCCCC2

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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 C25H37NO5S MW 463.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H37NO5S/c1-2-31-25(30)21-19-15-9-7-5-3-4-6-8-10-16-20(19)32-23(21)26-22(27)17-13-11-12-14-18(17)24(28)29/h17-18H,2-16H2,1H3,(H,26,27)(H,28,29)
InChIKey
SZMKHYLMFCQDMN-UHFFFAOYSA-N
Synonyms

2((3(ethoxycarbonyl)45678910111213decahydrocyclododeca(b)thiophen2yl)carbamoyl)cyclohexanecarboxylicacid
2((3ethoxycarbonyl45678910111213decahydrocyclododeca(b)thiophen2yl)carbamoyl)cyclohexane1carboxylicacid
CCOC(=O)C1=C(SC2=C1CCCCCCCCCC2)NC(=O)C3CCCCC3C(=O)O
InChI=1SC25H37NO5Sc123125(30)2119159753468101620(19)3223(21)2622(27)171311121418(17)24(28)29h1718H216H21H3(H2627)(H2829)
MFCD01923817
ZINC000020168311
ZINC000020168317

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Available files

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