Vitas-M small molecule compound

4-methyl-2-oxo-2H-chromen-7-yl [(4-benzyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetate

Catalog ID
STK753658
SMILES O=C(Oc1ccc2c(c1)oc(=O)cc2C)CSc1nc(Cc2ccccc2)cc(=O)[nH]1

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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 C23H18N2O5S MW 434.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N2O5S/c1-14-9-21(27)30-19-12-17(7-8-18(14)19)29-22(28)13-31-23-24-16(11-20(26)25-23)10-15-5-3-2-4-6-15/h2-9,11-12H,10,13H2,1H3,(H,24,25,26)
InChIKey
LHQDEPKMOZBCQL-UHFFFAOYSA-N
Synonyms

(4METHYL2OXOCHROMEN7YL)2((6BENZYL4OXO1HPYRIMIDIN2YL)SULFANYL)ACETATE
4methyl2oxo2Hchromen7yl((4benzyl6oxo16dihydropyrimidin2yl)sulfanyl)acetate
4METHYL2OXO2HCHROMEN7YL((6BENZYL4OXO14DIHYDROPYRIMIDIN2YL)SULFANYL)ACETATE
CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)CSC3=NC(=O)C=C(N3)CC4=CC=CC=C4
InChI=1SC23H18N2O5Sc114921(27)30191217(7818(14)19)2922(28)1331232416(1120(26)2523)10155324615h291112H1013H21H3(H242526)
MFCD00824273
O=C(Oc1ccc2c(c1)oc(=O)cc2C)CSc1nc(Cc2ccccc2)cc(=O)(nH)1
ZINC000001056171
ZINC1056171

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Available files

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