Vitas-M small molecule compound

methyl 2-{[(1,3-benzodioxol-5-yloxy)acetyl]amino}-4,5-dimethylthiophene-3-carboxylate

Catalog ID
STK677823
SMILES COC(=O)c1c(NC(=O)COc2ccc3c(c2)OCO3)sc(c1C)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 C17H17NO6S MW 363.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17NO6S/c1-9-10(2)25-16(15(9)17(20)21-3)18-14(19)7-22-11-4-5-12-13(6-11)24-8-23-12/h4-6H,7-8H2,1-3H3,(H,18,19)
InChIKey
MVJCCCOGWDAOOZ-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=C1C(=O)OC)NC(=O)COC2=CC3=C(C=C2)OCO3)C
InChI=1SC17H17NO6Sc1910(2)2516(15(9)17(20)213)1814(19)72211451213(611)2482312h46H78H213H3(H1819)
methyl2(((13benzodioxol5yloxy)acetyl)amino)45dimethylthiophene3carboxylate
METHYL2((2(13BENZODIOXOL5YLOXY)ACETYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
METHYL2(2(2HBENZO(34D)13DIOXOLEN5YLOXY)ACETYLAMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
MFCD02928375
ZINC000001102614
ZINC01102614
ZINC1102614

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Available files

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