Vitas-M small molecule compound
(2E)-3-(4-bromophenyl)-N-({4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl}carbamothioyl)prop-2-enamide
Catalog ID
STK674158
SMILES COc1nc(OC)nc(c1)NS(=O)(=O)c1ccc(cc1)NC(=S)NC(=O)/C=C/c1ccc(cc1)Br
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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 C22H20BrN5O5S2 MW 578.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BrN5O5S2/c1-32-20-13-18(25-21(27-20)33-2)28-35(30,31)17-10-8-16(9-11-17)24-22(34)26-19(29)12-5-14-3-6-15(23)7-4-14/h3-13H,1-2H3,(H,25,27,28)(H2,24,26,29,34)/b12-5+InChIKey
MOBLKAXRWBGIKP-LFYBBSHMSA-NSynonyms
312276-93-0(2E)3(4bromophenyl)N((4((26dimethoxypyrimidin4yl)sulfamoyl)phenyl)carbamothioyl)prop2enamide
(E)3(4BROMOPHENYL)N((4((26DIMETHOXYPYRIMIDIN4YL)SULFAMOYL)PHENYL)CARBAMOTHIOYL)PROP2ENAMIDE
(E)3(4bromophenyl)N((4(N(26dimethoxypyrimidin4yl)sulfamoyl)phenyl)carbamothioyl)acrylamide
312276930
COC1=NC(=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C=CC3=CC=C(C=C3)Br)OC
COc1nc(OC)nc(c1)NS(=O)(=O)c1ccc(cc1)NC(=S)NC(=O)C=Cc1ccc(cc1)Br
InChI=1SC22H20BrN5O5S2c132201318(2521(2720)332)2835(3031)1710816(91117)2422(34)2619(29)125143615(23)7414h313H12H3(H252728)(H224262934)b125+
MFCD01155761
ZINC000006023862
ZINC6023862
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