Vitas-M small molecule compound
(2E)-N-({4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl}carbamothioyl)-3-[4-(propan-2-yl)phenyl]prop-2-enamide
Catalog ID
STK543534
SMILES COc1nc(OC)nc(c1)NS(=O)(=O)c1ccc(cc1)NC(=S)NC(=O)/C=C/c1ccc(cc1)C(C)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 C25H27N5O5S2 MW 541.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N5O5S2/c1-16(2)18-8-5-17(6-9-18)7-14-22(31)28-25(36)26-19-10-12-20(13-11-19)37(32,33)30-21-15-23(34-3)29-24(27-21)35-4/h5-16H,1-4H3,(H,27,29,30)(H2,26,28,31,36)/b14-7+InChIKey
VHIDDOAFESJTGG-VGOFMYFVSA-NSynonyms
481642-61-9(2E)N((4((26dimethoxypyrimidin4yl)sulfamoyl)phenyl)carbamothioyl)3(4(propan2yl)phenyl)prop2enamide
(E)N((4((26DIMETHOXYPYRIMIDIN4YL)SULFAMOYL)PHENYL)CARBAMOTHIOYL)3(4PROPAN2YLPHENYL)PROP2ENAMIDE
(E)N((4(N(26dimethoxypyrimidin4yl)sulfamoyl)phenyl)carbamothioyl)3(4isopropylphenyl)acrylamide
481642619
CC(C)C1=CC=C(C=C1)C=CC(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC(=NC(=N3)OC)OC
COc1nc(OC)nc(c1)NS(=O)(=O)c1ccc(cc1)NC(=S)NC(=O)C=Cc1ccc(cc1)C(C)C
InChI=1SC25H27N5O5S2c116(2)188517(6918)71422(31)2825(36)2619101220(131119)37(3233)30211523(343)2924(2721)354h516H14H3(H272930)(H226283136)b147+
MFCD00761224
ZINC000006077016
ZINC6077016
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