Vitas-M small molecule compound
6-amino-2-(2,5-dimethylphenyl)-1,3-dioxo-2,3-dihydro-1H-benzo[de]isoquinoline-5-sulfonic acid
Catalog ID
STL295546
SMILES Cc1ccc(c(c1)n1c(=O)c2cc(c(c3c2c(c1=O)ccc3)N)S(=O)(=O)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 C20H16N2O5S MW 396.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N2O5S/c1-10-6-7-11(2)15(8-10)22-19(23)13-5-3-4-12-17(13)14(20(22)24)9-16(18(12)21)28(25,26)27/h3-9H,21H2,1-2H3,(H,25,26,27)InChIKey
SOAZCKCESFSJIE-UHFFFAOYSA-NSynonyms
6amino2(25dimethylphenyl)13dioxo23dihydro1Hbenzo(de)isoquinoline5sulfonicacid
6AMINO2(25DIMETHYLPHENYL)13DIOXOBENZO(DE)ISOQUINOLINE5SULFONICACID
CC1=CC(=C(C=C1)C)N2C(=O)C3=CC=CC4=C3C(=CC(=C4N)S(=O)(=O)O)C2=O
InChI=1SC20H16N2O5Sc1106711(2)15(810)2219(23)135341217(13)14(20(22)24)916(18(12)21)28(2526)27h39H21H212H3(H252627)
MFCD00660745
ZINC000003045308
ZINC3045308
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