Vitas-M small molecule compound

4-({[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}amino)benzenesulfonate

Catalog ID
STK719984
SMILES O=C(Nc1ccc(cc1)S(=O)(=O)[O-])COc1ccc2c(c1)oc(=O)cc2C

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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 C18H14NO7S MW 388.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15NO7S/c1-11-8-18(21)26-16-9-13(4-7-15(11)16)25-10-17(20)19-12-2-5-14(6-3-12)27(22,23)24/h2-9H,10H2,1H3,(H,19,20)(H,22,23,24)/p-1
InChIKey
UTCAGNQQYBAYSD-UHFFFAOYSA-M
Synonyms

4((((4methyl2oxo2Hchromen7yl)oxy)acetyl)amino)benzenesulfonate
4((2(4METHYL2OXOCHROMEN7YL)OXYACETYL)AMINO)BENZENESULFONATE
CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NC3=CC=C(C=C3)S(=O)(=O)(O)
InChI=1SC18H15NO7Sc111818(21)2616913(4715(11)16)251017(20)19122514(6312)27(2223)24h29H10H21H3(H1920)(H222324)p1
MFCD01240809
O=C(Nc1ccc(cc1)S(=O)(=O)(O))COc1ccc2c(c1)oc(=O)cc2C
ZINC000002189044
ZINC02189044

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Available files

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