Vitas-M small molecule compound
6-{[4-ethyl-3-(methoxycarbonyl)-5-methylthiophen-2-yl]carbamoyl}cyclohex-3-ene-1-carboxylic acid
Catalog ID
STK430109
SMILES COC(=O)c1c(NC(=O)C2CC=CCC2C(=O)O)sc(c1CC)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 C17H21NO5S MW 351.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21NO5S/c1-4-10-9(2)24-15(13(10)17(22)23-3)18-14(19)11-7-5-6-8-12(11)16(20)21/h5-6,11-12H,4,7-8H2,1-3H3,(H,18,19)(H,20,21)InChIKey
WHSQHUYIOSUDIN-UHFFFAOYSA-NSynonyms
6((4ethyl3(methoxycarbonyl)5methylthiophen2yl)carbamoyl)cyclohex3ene1carboxylicacid
6((4ETHYL3METHOXYCARBONYL5METHYLTHIOPHEN2YL)CARBAMOYL)CYCLOHEX3ENE1CARBOXYLICACID
6(N(4ETHYL3(METHOXYCARBONYL)5METHYL2THIENYL)CARBAMOYL)CYCLOHEX3ENECARBOXYLICACID
CCC1=C(SC(=C1C(=O)OC)NC(=O)C2CC=CCC2C(=O)O)C
InChI=1SC17H21NO5Sc14109(2)2415(13(10)17(22)233)1814(19)11756812(11)16(20)21h561112H478H213H3(H1819)(H2021)
MFCD02174202
ZINC000002748173
ZINC000002748176
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