Vitas-M small molecule compound
2,6-dimethoxy-4-[(Z)-(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-9-ium-2(3H)-ylidene)methyl]phenolate
Catalog ID
STK559467
SMILES COc1cc(cc(c1[O-])OC)/C=c/1\sc2n(c1=O)c1c([nH+]2)cccc1
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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 C18H14N2O4S MW 354.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N2O4S/c1-23-13-7-10(8-14(24-2)16(13)21)9-15-17(22)20-12-6-4-3-5-11(12)19-18(20)25-15/h3-9,21H,1-2H3/b15-9-InChIKey
XUNAVOHRHRXQKI-DHDCSXOGSA-NSynonyms
1622998-07-51622998075
26dimethoxy4((Z)(3oxo(13)thiazolo(32a)benzimidazol9ium2(3H)ylidene)methyl)phenolate
COC1=CC(=CC(=C1O)OC)C=C2C(=O)N3C4=CC=CC=C4N=C3S2
COc1cc(cc(c1(O))OC)C=c1sc2n(c1=O)c1c((nH+)2)cccc1
InChI=1SC18H14N2O4Sc12313710(814(242)16(13)21)91517(22)2012643511(12)1918(20)2515h3921H12H3b159
MFCD01572664
ZINC000008657243
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