Vitas-M small molecule compound

methyl 2-[(3-cyclohexylpropanoyl)amino]-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate

Catalog ID
STK459495
SMILES COC(=O)c1c(NC(=O)CCC2CCCCC2)sc(c1C)C(=O)N(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 C19H28N2O4S MW 380.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H28N2O4S/c1-12-15(19(24)25-4)17(26-16(12)18(23)21(2)3)20-14(22)11-10-13-8-6-5-7-9-13/h13H,5-11H2,1-4H3,(H,20,22)
InChIKey
PFEJQBPWWBRLAM-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=C1C(=O)OC)NC(=O)CCC2CCCCC2)C(=O)N(C)C
InChI=1SC19H28N2O4Sc11215(19(24)254)17(2616(12)18(23)21(2)3)2014(22)1110138657913h13H511H214H3(H2022)
methyl2((3cyclohexylpropanoyl)amino)5(dimethylcarbamoyl)4methylthiophene3carboxylate
METHYL2(3CYCLOHEXYLPROPANOYLAMINO)5(DIMETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
METHYL5(NNDIMETHYLCARBAMOYL)2(3CYCLOHEXYLPROPANOYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
MFCD03389921
ZINC000006254130
ZINC06254130
ZINC6254130

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.