Vitas-M small molecule compound
3-(1,3-benzothiazol-2-yl)-8-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-2-methyl-4-oxo-6-propyl-4H-chromen-7-olate
Catalog ID
STL514093
SMILES OCCN1CC[NH+](CC1)Cc1c([O-])c(CCC)cc2c1oc(C)c(c2=O)c1nc2c(s1)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 C27H31N3O4S MW 493.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N3O4S/c1-3-6-18-15-19-25(33)23(27-28-21-7-4-5-8-22(21)35-27)17(2)34-26(19)20(24(18)32)16-30-11-9-29(10-12-30)13-14-31/h4-5,7-8,15,31-32H,3,6,9-14,16H2,1-2H3InChIKey
VZGWRKGTIAWJAS-UHFFFAOYSA-NSynonyms
384360-64-91427226
384360649
MFCD03265880
ZINC000001322508
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