Vitas-M small molecule compound

propan-2-yl 5-carbamoyl-2-[(N-cyclohexyl-N-methylglycyl)amino]-4-methylthiophene-3-carboxylate

Catalog ID
STK458772
SMILES O=C(Nc1sc(c(c1C(=O)OC(C)C)C)C(=O)N)CN(C1CCCCC1)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 C19H29N3O4S MW 395.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H29N3O4S/c1-11(2)26-19(25)15-12(3)16(17(20)24)27-18(15)21-14(23)10-22(4)13-8-6-5-7-9-13/h11,13H,5-10H2,1-4H3,(H2,20,24)(H,21,23)
InChIKey
VIGSLMSELIBVBM-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)CN(C)C2CCCCC2)C(=O)N
InChI=1SC19H29N3O4Sc111(2)2619(25)1512(3)16(17(20)24)2718(15)2114(23)1022(4)138657913h1113H510H214H3(H22024)(H2123)
MFCD05123298
PROPAN2YL5CARBAMOYL2((2(CYCLOHEXYL(METHYL)AMINO)ACETYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
propan2yl5carbamoyl2((NcyclohexylNmethylglycyl)amino)4methylthiophene3carboxylate
ZINC000006008350
ZINC6008350

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Available files

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