Vitas-M small molecule compound

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(5-ethoxy-1H-benzimidazol-2-yl)sulfanyl]acetamide

Catalog ID
STK202478
SMILES CCOc1ccc2c(c1)nc([nH]2)SCC(=O)Nc1ccc2c(c1)OCCO2

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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 C19H19N3O4S MW 385.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O4S/c1-2-24-13-4-5-14-15(10-13)22-19(21-14)27-11-18(23)20-12-3-6-16-17(9-12)26-8-7-25-16/h3-6,9-10H,2,7-8,11H2,1H3,(H,20,23)(H,21,22)
InChIKey
DOTHVSWEOKOLFS-UHFFFAOYSA-N
Synonyms
694508-06-0
694508060
CCOC1=CC2=C(C=C1)N=C(N2)SCC(=O)NC3=CC4=C(C=C3)OCCO4
CCOc1ccc2c(c1)nc((nH)2)SCC(=O)Nc1ccc2c(c1)OCCO2
InChI=1SC19H19N3O4Sc122413451415(1013)2219(2114)271118(23)2012361617(912)26872516h36910H27811H21H3(H2023)(H2122)
MFCD03910182
N(23DIHYDRO14BENZODIOXIN6YL)2((5ETHOXY1HBENZIMIDAZOL2YL)SULFANYL)ACETAMIDE
N(23DIHYDRO14BENZODIOXIN6YL)2((5ETHOXY1HBENZIMIDAZOL2YL)THIO)ACETAMIDE
N(23DIHYDRO14BENZODIOXIN6YL)2((6ETHOXY1HBENZIMIDAZOL2YL)SULFANYL)ACETAMIDE
ZINC000005573619
ZINC05573619
ZINC5573619

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Available files

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