Vitas-M small molecule compound
{3-[(amino-kappaN)(methylsulfanyl)methylidene]pentane-2,4-dionato-kappaO~2~}(diphenyl)boron
Catalog ID
STK164675
SMILES CSC1=C(C(=O)C)C(=[O+][B-](N1)(c1ccccc1)c1ccccc1)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 C19H20BNO2S MW 337.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20BNO2S/c1-14(22)18-15(2)23-20(21-19(18)24-3,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13,21H,1-3H3InChIKey
IVXYAHKKLXMDIM-UHFFFAOYSA-NSynonyms
(3((aminokappaN)(methylsulfanyl)methylidene)pentane24dionatokappaO~2~)(diphenyl)boron
(3((AMINOKAPPAN)(METHYLSULFANYL)METHYLIDENE)PENTANE24DIONATOKAPPAO2)(DIPHENYL)BORON
(B)1((NH+)=C(C(=C(O1)C)C(=O)C)SC)(C2=CC=CC=C2)C3=CC=CC=C3
1(6METHYL4METHYLSULFANYL22DIPHENYL1OXA3AZONIA2BORANUIDACYCLOHEXA35DIEN5YL)ETHANONE
5acetyl6methyl4(methylthio)22diphenyl23dihydro132oxazaborinin1ium2uide
CSC1=C(C(=O)C)C(=(O+)(B)(N1)(c1ccccc1)c1ccccc1)C
InChI=1SC19H20BNO2Sc114(22)1815(2)2320(2119(18)24316106471116)17128591317h41321H13H3
MFCD03759894
ZINC217363458
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