Vitas-M small molecule compound
3-{[(5-{[2-oxo-2-(2-oxo-3,8a-dihydro-2H-chromen-3-yl)ethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl}-2H-chromen-2-one
Catalog ID
STK016751
SMILES O=C(C1C=C2C=CC=CC2OC1=O)CSc1nnc(s1)SCC(=O)c1cc2ccccc2oc1=O
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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 C24H16N2O6S3 MW 524.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H16N2O6S3/c27-17(15-9-13-5-1-3-7-19(13)31-21(15)29)11-33-23-25-26-24(35-23)34-12-18(28)16-10-14-6-2-4-8-20(14)32-22(16)30/h1-10,15,19H,11-12H2InChIKey
HJBXJQCLUFDDAY-UHFFFAOYSA-NSynonyms
3(((5((2OXO2(2OXO38ADIHYDRO2HCHROMEN3YL)ETHYL)SULFANYL)134THIADIAZOL2YL)SULFANYL)ACETYL)2HCHROMEN2ONE
3(2((5(2OXO2(2OXO38ADIHYDROCHROMEN3YL)ETHYL)SULFANYL134THIADIAZOL2YL)SULFANYL)ACETYL)CHROMEN2ONE
C1=CC=C2C(=C1)C=C(C(=O)O2)C(=O)CSC3=NN=C(S3)SCC(=O)C4C=C5C=CC=CC5OC4=O
InChI=1SC24H16N2O6S3c2717(15913513719(13)3121(15)29)113323252624(3523)341218(28)161014624820(14)3222(16)30h1101519H1112H2
MFCD08049651
O=C(C1C=C2C=CC=CC2OC1=O)CSc1nnc(s1)SCC(=O)c1cc2ccccc2oc1=O
STK016751
ZINC000098044762
ZINC000101397480
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