Vitas-M small molecule compound
2-amino-5-{[4-bromo-1-(ethoxycarbonyl)-2-methyl-7-oxo-7H-naphtho[1,2,3-de]quinolin-6-yl]amino}benzenesulfonate
Catalog ID
STK368130
SMILES CCOC(=O)c1c(C)nc2c3c1c1ccccc1C(=O)c3c(cc2Br)Nc1ccc(c(c1)S(=O)(=O)[O-])N
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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 C26H19BrN3O6S MW 581.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20BrN3O6S/c1-3-36-26(32)20-12(2)29-24-16(27)11-18(30-13-8-9-17(28)19(10-13)37(33,34)35)22-23(24)21(20)14-6-4-5-7-15(14)25(22)31/h4-11,30H,3,28H2,1-2H3,(H,33,34,35)/p-1InChIKey
DSSBSLBOVDEXNN-UHFFFAOYSA-MSynonyms
2amino5((4bromo1(ethoxycarbonyl)2methyl7oxo7Hnaphtho(123de)quinolin6yl)amino)benzenesulfonate
CCOC(=O)C1=C2C3=CC=CC=C3C(=O)C4=C2C(=C(C=C4NC5=CC(=C(C=C5)N)S(=O)(=O)(O))Br)N=C1C
CCOC(=O)c1c(C)nc2c3c1c1ccccc1C(=O)c3c(cc2Br)Nc1ccc(c(c1)S(=O)(=O)(O))N
InChI=1SC26H20BrN3O6Sc133626(32)2012(2)292416(27)1118(30138917(28)19(1013)37(3334)35)2223(24)21(20)14645715(14)25(22)31h41130H328H212H3(H333435)p1
ZINC000003144458
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