Vitas-M small molecule compound

3,4,7-trimethyl-2-oxo-2H-chromen-5-yl N-[(4-methylphenyl)sulfonyl]-beta-alaninate

Catalog ID
STL462473
SMILES O=C(Oc1cc(C)cc2c1c(C)c(c(=O)o2)C)CCNS(=O)(=O)c1ccc(cc1)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 C22H23NO6S MW 429.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO6S/c1-13-5-7-17(8-6-13)30(26,27)23-10-9-20(24)28-18-11-14(2)12-19-21(18)15(3)16(4)22(25)29-19/h5-8,11-12,23H,9-10H2,1-4H3
InChIKey
MRZXLVRYAYDDCF-UHFFFAOYSA-N
Synonyms
858752-59-7
(347TRIMETHYL2OXOCHROMEN5YL)3((4METHYLPHENYL)SULFONYLAMINO)PROPANOATE
347trimethyl2oxo2Hchromen5yl3(4methylphenylsulfonamido)propanoate
347trimethyl2oxo2Hchromen5ylN((4methylphenyl)sulfonyl)betaalaninate
858752597
CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OC2=CC(=CC3=C2C(=C(C(=O)O3)C)C)C
InChI=1SC22H23NO6Sc1135717(8613)30(2627)2310920(24)28181114(2)121921(18)15(3)16(4)22(25)2919h58111223H910H214H3
MFCD03853676
ZINC000002095612
ZINC02095612
ZINC2095612

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Available files

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