Vitas-M small molecule compound
N-(2-{[2-(3-methylphenyl)-1,3-dioxo-2,3-dihydro-1H-benzo[de]isoquinolin-6-yl]sulfanyl}phenyl)acetamide
Catalog ID
STL295547
SMILES CC(=O)Nc1ccccc1Sc1ccc2c3c1cccc3c(=O)n(c2=O)c1cccc(c1)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 C27H20N2O3S MW 452.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20N2O3S/c1-16-7-5-8-18(15-16)29-26(31)20-10-6-9-19-23(14-13-21(25(19)20)27(29)32)33-24-12-4-3-11-22(24)28-17(2)30/h3-15H,1-2H3,(H,28,30)InChIKey
GEVFMAKQZPVXKF-UHFFFAOYSA-NSynonyms
CC1=CC(=CC=C1)N2C(=O)C3=C4C(=C(C=C3)SC5=CC=CC=C5NC(=O)C)C=CC=C4C2=O
InChI=1SC27H20N2O3Sc11675818(1516)2926(31)2010691923(141321(25(19)20)27(29)32)332412431122(24)2817(2)30h315H12H3(H2830)
MFCD00659914
N(2((2(3methylphenyl)13dioxo23dihydro1Hbenzo(de)isoquinolin6yl)sulfanyl)phenyl)acetamide
N(2(2(3methylphenyl)13dioxobenzo(de)isoquinolin6yl)sulfanylphenyl)acetamide
ZINC000095471050
ZINC95471050
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