Vitas-M small molecule compound

N-[2-(3,4-dimethoxyphenyl)ethyl]-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonamide

Catalog ID
STK279292
SMILES COc1cc(CCNS(=O)(=O)c2ccc3c(c2)CCCC(=O)N3)ccc1OC

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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 C20H24N2O5S MW 404.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N2O5S/c1-26-18-9-6-14(12-19(18)27-2)10-11-21-28(24,25)16-7-8-17-15(13-16)4-3-5-20(23)22-17/h6-9,12-13,21H,3-5,10-11H2,1-2H3,(H,22,23)
InChIKey
UUTASVXEYGJJDS-UHFFFAOYSA-N
Synonyms

COC1=C(C=C(C=C1)CCNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CCC3)OC
InChI=1SC20H24N2O5Sc126189614(1219(18)272)10112128(2425)16781715(1316)43520(23)2217h69121321H351011H212H3(H2223)
MFCD09269730
N(2(34dimethoxyphenyl)ethyl)2oxo1345tetrahydro1benzazepine7sulfonamide
N(2(34dimethoxyphenyl)ethyl)2oxo2345tetrahydro1H1benzazepine7sulfonamide
ZINC000009096159
ZINC09096159
ZINC9096159

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Available files

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