Vitas-M small molecule compound
6-amino-2-(4-ethoxyphenyl)-1,3-dioxo-2,3-dihydro-1H-benzo[de]isoquinoline-5-sulfonic acid
Catalog ID
STL295319
SMILES CCOc1ccc(cc1)n1c(=O)c2cccc3c2c(c1=O)cc(c3N)S(=O)(=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 C20H16N2O6S MW 412.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N2O6S/c1-2-28-12-8-6-11(7-9-12)22-19(23)14-5-3-4-13-17(14)15(20(22)24)10-16(18(13)21)29(25,26)27/h3-10H,2,21H2,1H3,(H,25,26,27)InChIKey
BMKNPFSBJQPYBC-UHFFFAOYSA-NSynonyms
6amino2(4ethoxyphenyl)13dioxo23dihydro1Hbenzo(de)isoquinoline5sulfonicacid
6amino2(4ethoxyphenyl)13dioxobenzo(de)isoquinoline5sulfonicacid
CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC4=C3C(=CC(=C4N)S(=O)(=O)O)C2=O
InChI=1SC20H16N2O6Sc1228128611(7912)2219(23)145341317(14)15(20(22)24)1016(18(13)21)29(2526)27h310H221H21H3(H252627)
MFCD00660760
ZINC000095470977
ZINC95470977
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