Vitas-M small molecule compound
methyl 3-(1-acetyl-1H-indol-3-yl)-3-(acetylsulfanyl)-2-nitropropanoate
Catalog ID
STK062802
SMILES COC(=O)C(C(c1cn(c2c1cccc2)C(=O)C)SC(=O)C)[N+](=O)[O-]
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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 C16H16N2O6S MW 364.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O6S/c1-9(19)17-8-12(11-6-4-5-7-13(11)17)15(25-10(2)20)14(18(22)23)16(21)24-3/h4-8,14-15H,1-3H3InChIKey
QUDSEISCSVORLY-UHFFFAOYSA-NSynonyms
1189907-69-41189907694
CC(=O)N1C=C(C2=CC=CC=C21)C(C(C(=O)OC)(N+)(=O)(O))SC(=O)C
COC(=O)C(C(c1cn(c2c1cccc2)C(=O)C)SC(=O)C)(N+)(=O)(O)
InChI=1SC16H16N2O6Sc19(19)17812(11645713(11)17)15(2510(2)20)14(18(22)23)16(21)243h481415H13H3
METHYL(2R3S)3(1ACETYL1HINDOL3YL)3(ACETYLSULFANYL)2NITROPROPANOATE
METHYL(2S3S)3(1ACETYL1HINDOL3YL)3(ACETYLSULFANYL)2NITROPROPANOATE
METHYL3(1ACETYL1HINDOL3YL)3(ACETYLSULFANYL)2NITROPROPANOATE
methyl3(1acetyl1Hindol3yl)3(acetylthio)2nitropropanoate
METHYL3(1ACETYLINDOL3YL)3ACETYLSULFANYL2NITROPROPANOATE
MFCD00377694
STK062802
ZINC000002239926
ZINC000002239929
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