Vitas-M small molecule compound
3-benzyl-2,6-dioxo-3,5a,6,11b-tetrahydro-2H,5H-chromeno[4',3':4,5]thiopyrano[2,3-d][1,3]thiazole-5-carboxylic acid
Catalog ID
STK666699
SMILES OC(=O)C1Sc2c(C3C1C(=O)Oc1c3cccc1)sc(=O)n2Cc1ccccc1
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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 C21H15NO5S2 MW 425.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15NO5S2/c23-19(24)17-15-14(12-8-4-5-9-13(12)27-20(15)25)16-18(28-17)22(21(26)29-16)10-11-6-2-1-3-7-11/h1-9,14-15,17H,10H2,(H,23,24)InChIKey
BCVYKZKWAFPITF-UHFFFAOYSA-NSynonyms
1005142-08-41005142084
3benzyl26dioxo2355a611bhexahydrochromeno(4345)thiopyrano(23d)thiazole5carboxylicacid
3benzyl26dioxo35a611btetrahydro2H5Hchromeno(4345)thiopyrano(23d)(13)thiazole5carboxylicacid
C1=CC=C(C=C1)CN2C3=C(C4C(C(S3)C(=O)O)C(=O)OC5=CC=CC=C45)SC2=O
InChI=1SC21H15NO5S2c2319(24)171514(12845913(12)2720(15)25)1618(2817)22(21(26)2916)10116213711h19141517H10H2(H2324)
MFCD03409397
ZINC000000727945
ZINC000008868038
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