Vitas-M small molecule compound
(2Z)-7-{[benzyl(methyl)ammonio]methyl}-3-oxo-2-(thiophen-2-ylmethylidene)-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK848268
SMILES C[NH+](Cc1c([O-])ccc2c1O/C(=C\c1cccs1)/C2=O)Cc1ccccc1
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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 C22H19NO3S MW 377.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19NO3S/c1-23(13-15-6-3-2-4-7-15)14-18-19(24)10-9-17-21(25)20(26-22(17)18)12-16-8-5-11-27-16/h2-12,24H,13-14H2,1H3/b20-12-InChIKey
IZYDUKGRIQDCAW-NDENLUEZSA-NSynonyms
896068-15-8(2Z)7((benzyl(methyl)ammonio)methyl)3oxo2(thiophen2ylmethylidene)23dihydro1benzofuran6olate
896068158
C(NH+)(Cc1c((O))ccc2c1OC(=Cc1cccs1)C2=O)Cc1ccccc1
CN(CC1=CC=CC=C1)CC2=C(C=CC3=C2OC(=CC4=CC=CS4)C3=O)O
InChI=1SC22H19NO3Sc123(13156324715)141819(24)1091721(25)20(2622(17)18)121685112716h21224H1314H21H3b2012
MFCD06591524
ZINC000020503206
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