Vitas-M small molecule compound

methyl 2-[(1,3-benzodioxol-5-ylcarbonyl)amino]-5-propylthiophene-3-carboxylate

Catalog ID
STK463668
SMILES CCCc1cc(c(s1)NC(=O)c1ccc2c(c1)OCO2)C(=O)OC

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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 C17H17NO5S MW 347.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17NO5S/c1-3-4-11-8-12(17(20)21-2)16(24-11)18-15(19)10-5-6-13-14(7-10)23-9-22-13/h5-8H,3-4,9H2,1-2H3,(H,18,19)
InChIKey
FFCWDJQNWRICFO-UHFFFAOYSA-N
Synonyms

CCCC1=CC(=C(S1)NC(=O)C2=CC3=C(C=C2)OCO3)C(=O)OC
InChI=1SC17H17NO5Sc13411812(17(20)212)16(2411)1815(19)10561314(710)2392213h58H349H212H3(H1819)
methyl2((13benzodioxol5ylcarbonyl)amino)5propylthiophene3carboxylate
METHYL2(13BENZODIOXOLE5CARBONYLAMINO)5PROPYLTHIOPHENE3CARBOXYLATE
METHYL2(2HBENZO(34D)13DIOXOLAN5YLCARBONYLAMINO)5PROPYLTHIOPHENE3CARBOXYLATE
MFCD06004633
ZINC000001054760
ZINC01054760
ZINC1054760

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Available files

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