Vitas-M small molecule compound

6-{[3-(cyclopentylcarbamoyl)-4-ethyl-5-methylthiophen-2-yl]carbamoyl}-3,4-dimethylcyclohex-3-ene-1-carboxylic acid

Catalog ID
STK471301
SMILES CCc1c(C)sc(c1C(=O)NC1CCCC1)NC(=O)C1CC(=C(CC1C(=O)O)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 C23H32N2O4S MW 432.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H32N2O4S/c1-5-16-14(4)30-22(19(16)21(27)24-15-8-6-7-9-15)25-20(26)17-10-12(2)13(3)11-18(17)23(28)29/h15,17-18H,5-11H2,1-4H3,(H,24,27)(H,25,26)(H,28,29)
InChIKey
IAIOGLRHVGIZAP-UHFFFAOYSA-N
Synonyms

6((3(cyclopentylcarbamoyl)4ethyl5methylthiophen2yl)carbamoyl)34dimethylcyclohex3ene1carboxylicacid
6(N(3(NCYCLOPENTYLCARBAMOYL)4ETHYL5METHYL(2THIENYL))CARBAMOYL)34DIMETHYLCYCLOHEX3ENECARBOXYLICACID
CCC1=C(SC(=C1C(=O)NC2CCCC2)NC(=O)C3CC(=C(CC3C(=O)O)C)C)C
InChI=1SC23H32N2O4Sc151614(4)3022(19(16)21(27)2415867915)2520(26)171012(2)13(3)1118(17)23(28)29h151718H511H214H3(H2427)(H2526)(H2829)
MFCD06025389
ZINC000017098098
ZINC000017098101

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Available files

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