Vitas-M small molecule compound
(2Z)-7-[(dimethylammonio)methyl]-2-[(3-methylthiophen-2-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK850380
SMILES C[NH+](Cc1c([O-])ccc2c1O/C(=C\c1sccc1C)/C2=O)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 C17H17NO3S MW 315.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17NO3S/c1-10-6-7-22-15(10)8-14-16(20)11-4-5-13(19)12(9-18(2)3)17(11)21-14/h4-8,19H,9H2,1-3H3/b14-8-InChIKey
FCPXYZIXJQYMOE-ZSOIEALJSA-NSynonyms
896075-40-4(2Z)7((dimethylamino)methyl)6hydroxy2((3methylthiophen2yl)methylidene)1benzofuran3one
(2Z)7((dimethylammonio)methyl)2((3methylthiophen2yl)methylidene)3oxo23dihydro1benzofuran6olate
(2Z)7(DIMETHYLAMINOMETHYL)6HYDROXY2((3METHYLTHIOPHEN2YL)METHYLIDENE)1BENZOFURAN3ONE
7((DIMETHYLAMINO)METHYL)6HYDROXY2((3METHYL(2THIENYL))METHYLENE)BENZO(B)FURAN3ONE
896075404
C(NH+)(Cc1c((O))ccc2c1OC(=Cc1sccc1C)C2=O)C
CC1=C(SC=C1)C=C2C(=O)C3=C(O2)C(=C(C=C3)O)CN(C)C
InChI=1SC17H17NO3Sc110672215(10)81416(20)114513(19)12(918(2)3)17(11)2114h4819H9H213H3b148
MFCD06592827
ZINC000002439684
ZINC2439684
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