Vitas-M small molecule compound
2-(4-methoxyphenyl)-N-{4-[(4-nitrophenyl)sulfanyl]phenyl}-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide
Catalog ID
STK296382
SMILES COc1ccc(cc1)N1C(=O)c2c(C1=O)ccc(c2)C(=O)Nc1ccc(cc1)Sc1ccc(cc1)[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 C28H19N3O6S MW 525.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H19N3O6S/c1-37-21-9-5-19(6-10-21)30-27(33)24-15-2-17(16-25(24)28(30)34)26(32)29-18-3-11-22(12-4-18)38-23-13-7-20(8-14-23)31(35)36/h2-16H,1H3,(H,29,32)InChIKey
RVRBRFLTFVKUFT-UHFFFAOYSA-NSynonyms
2(4methoxyphenyl)N(4((4nitrophenyl)sulfanyl)phenyl)13dioxo23dihydro1Hisoindole5carboxamide
2(4methoxyphenyl)N(4(4nitrophenyl)sulfanylphenyl)13dioxoisoindole5carboxamide
COC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=CC=C(C=C4)SC5=CC=C(C=C5)(N+)(=O)(O)
COc1ccc(cc1)N1C(=O)c2c(C1=O)ccc(c2)C(=O)Nc1ccc(cc1)Sc1ccc(cc1)(N+)(=O)(O)
InChI=1SC28H19N3O6Sc137219519(61021)3027(33)2415217(1625(24)28(30)34)26(32)291831122(12418)382313720(81423)31(35)36h216H1H3(H2932)
MFCD00307834
ZINC000098043416
ZINC98043416
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