Vitas-M small molecule compound

1-acetyl-N-(6-cyano-1,3-benzodioxol-5-yl)-2,3-dihydro-1H-indole-6-sulfonamide

Catalog ID
STK773933
SMILES N#Cc1cc2OCOc2cc1NS(=O)(=O)c1ccc2c(c1)N(CC2)C(=O)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 C18H15N3O5S MW 385.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N3O5S/c1-11(22)21-5-4-12-2-3-14(7-16(12)21)27(23,24)20-15-8-18-17(25-10-26-18)6-13(15)9-19/h2-3,6-8,20H,4-5,10H2,1H3
InChIKey
WYBUBFMIXYHULK-UHFFFAOYSA-N
Synonyms

1acetylN(6cyano13benzodioxol5yl)23dihydro1Hindole6sulfonamide
1ACETYLN(6CYANO13BENZODIOXOL5YL)23DIHYDROINDOLE6SULFONAMIDE
CC(=O)N1CCC2=C1C=C(C=C2)S(=O)(=O)NC3=CC4=C(C=C3C#N)OCO4
InChI=1SC18H15N3O5Sc111(22)2154122314(716(12)21)27(2324)201581817(25102618)613(15)919h236820H4510H21H3
MFCD03855864
ZINC000004148038
ZINC04148038
ZINC4148038

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Available files

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