Vitas-M small molecule compound
6-{[3-(cyclopropylcarbamoyl)-4-ethyl-5-methylthiophen-2-yl]carbamoyl}-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
Catalog ID
STK471573
SMILES CCc1c(C)sc(c1C(=O)NC1CC1)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 C21H28N2O4S MW 404.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N2O4S/c1-5-14-12(4)28-20(17(14)19(25)22-13-6-7-13)23-18(24)15-8-10(2)11(3)9-16(15)21(26)27/h13,15-16H,5-9H2,1-4H3,(H,22,25)(H,23,24)(H,26,27)InChIKey
IPGQQYQCIHVJOH-UHFFFAOYSA-NSynonyms
6((3(cyclopropylcarbamoyl)4ethyl5methylthiophen2yl)carbamoyl)34dimethylcyclohex3ene1carboxylicacid
6(N(3(NCYCLOPROPYLCARBAMOYL)4ETHYL5METHYL(2THIENYL))CARBAMOYL)34DIMETHYLCYCLOHEX3ENECARBOXYLICACID
CCC1=C(SC(=C1C(=O)NC2CC2)NC(=O)C3CC(=C(CC3C(=O)O)C)C)C
InChI=1SC21H28N2O4Sc151412(4)2820(17(14)19(25)22136713)2318(24)15810(2)11(3)916(15)21(26)27h131516H59H214H3(H2225)(H2324)(H2627)
MFCD06026443
ZINC000017082926
ZINC000017082929
Check stock
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