Vitas-M small molecule compound

ethyl 4-[(2-{[(3-methyl-1-oxo-3,4-dihydro-1H-isochromen-3-yl)carbonyl]amino}-1,3-thiazol-5-yl)methyl]benzoate

Catalog ID
STL017437
SMILES CCOC(=O)c1ccc(cc1)Cc1cnc(s1)NC(=O)C1(C)OC(=O)c2c(C1)cccc2

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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 C24H22N2O5S MW 450.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N2O5S/c1-3-30-20(27)16-10-8-15(9-11-16)12-18-14-25-23(32-18)26-22(29)24(2)13-17-6-4-5-7-19(17)21(28)31-24/h4-11,14H,3,12-13H2,1-2H3,(H,25,26,29)
InChIKey
HXLLMRWGHRGCSJ-UHFFFAOYSA-N
Synonyms
833430-71-0
833430710
CCOC(=O)C1=CC=C(C=C1)CC2=CN=C(S2)NC(=O)C3(CC4=CC=CC=C4C(=O)O3)C
ethyl4((2(((3methyl1oxo34dihydro1Hisochromen3yl)carbonyl)amino)13thiazol5yl)methyl)benzoate
ETHYL4((2((3METHYL1OXO4HISOCHROMENE3CARBONYL)AMINO)13THIAZOL5YL)METHYL)BENZOATE
ETHYL4((2((3METHYL1OXOISOCHROMAN3YL)CARBONYLAMINO)13THIAZOL5YL)METHYL)BENZOATE
ETHYL4((2(3METHYL1OXOISOCHROMAN3CARBOXAMIDO)THIAZOL5YL)METHYL)BENZOATE
InChI=1SC24H22N2O5Sc133020(27)1610815(91116)1218142523(3218)2622(29)24(2)1317645719(17)21(28)3124h41114H31213H212H3(H252629)
MFCD05847565
ZINC000002709891
ZINC000002709893

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Available files

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