Vitas-M small molecule compound
3-(1,3-benzothiazol-2-yl)-8-[(dimethylammonio)methyl]-4-oxo-4H-chromen-7-olate
Catalog ID
STK577371
SMILES C[NH+](Cc1c([O-])ccc2c1occ(c2=O)c1nc2c(s1)cccc2)C
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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 C19H16N2O3S MW 352.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N2O3S/c1-21(2)9-12-15(22)8-7-11-17(23)13(10-24-18(11)12)19-20-14-5-3-4-6-16(14)25-19/h3-8,10,22H,9H2,1-2H3InChIKey
MSAORVFZOYRMPG-UHFFFAOYSA-NSynonyms
637747-61-63(13benzothiazol2yl)8((dimethylammonio)methyl)4oxo4Hchromen7olate
3(13benzothiazol2yl)8((dimethylazaniumyl)methyl)4oxochromen7olate
C(NH+)(C)CC1=C(C=CC2=C1OC=C(C2=O)C3=NC4=CC=CC=C4S3)(O)
C(NH+)(Cc1c((O))ccc2c1occ(c2=O)c1nc2c(s1)cccc2)C
InChI=1SC19H16N2O3Sc121(2)91215(22)871117(23)13(102418(11)12)192014534616(14)2519h381022H9H212H3
MFCD00705818
ZINC000019799372
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