Vitas-M small molecule compound

ethyl 4-{[(4,4-dioxido-3-phenyl-5,6-dihydro-1,4-oxathiin-2-yl)carbonyl]amino}benzoate

Catalog ID
STK647601
SMILES CCOC(=O)c1ccc(cc1)NC(=O)C1=C(c2ccccc2)S(=O)(=O)CCO1

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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 C20H19NO6S MW 401.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19NO6S/c1-2-26-20(23)15-8-10-16(11-9-15)21-19(22)17-18(14-6-4-3-5-7-14)28(24,25)13-12-27-17/h3-11H,2,12-13H2,1H3,(H,21,22)
InChIKey
PISTXRXGGFKMLN-UHFFFAOYSA-N
Synonyms
1144464-84-5
1144464845
CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(S(=O)(=O)CCO2)C3=CC=CC=C3
ethyl4(((44dioxido3phenyl56dihydro14oxathiin2yl)carbonyl)amino)benzoate
ethyl4((44dioxo5phenyl23dihydro14oxathiine6carbonyl)amino)benzoate
ethyl4(44dioxido3phenyl56dihydro14oxathiine2carboxamido)benzoate
InChI=1SC20H19NO6Sc122620(23)1581016(11915)2119(22)1718(146435714)28(2425)13122717h311H21213H21H3(H2122)
MFCD12214706
ZINC000032094166
ZINC32094166

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Available files

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