Vitas-M small molecule compound
4-{[(1E)-3-(1,3-benzodioxol-5-yl)-3-oxoprop-1-en-1-yl]amino}-N-(pyrimidin-2-yl)benzenesulfonamide
Catalog ID
STK859759
SMILES O=C(c1ccc2c(c1)OCO2)/C=C/Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1
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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 C20H16N4O5S MW 424.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N4O5S/c25-17(14-2-7-18-19(12-14)29-13-28-18)8-11-21-15-3-5-16(6-4-15)30(26,27)24-20-22-9-1-10-23-20/h1-12,21H,13H2,(H,22,23,24)/b11-8+InChIKey
MRNHQAPQNYPUDJ-DHZHZOJOSA-NSynonyms
(E)4((3(benzo(d)(13)dioxol5yl)3oxoprop1en1yl)amino)N(pyrimidin2yl)benzenesulfonamide
4(((1E)3(13benzodioxol5yl)3oxoprop1en1yl)amino)N(pyrimidin2yl)benzenesulfonamide
4(((E)3(13BENZODIOXOL5YL)3OXOPROP1ENYL)AMINO)NPYRIMIDIN2YLBENZENESULFONAMIDE
C1OC2=C(O1)C=C(C=C2)C(=O)C=CNC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4
InChI=1SC20H16N4O5Sc2517(14271819(1214)29132818)81121153516(6415)30(2627)24202291102320h11221H13H2(H222324)b118+
MFCD03283682
O=C(c1ccc2c(c1)OCO2)C=CNc1ccc(cc1)S(=O)(=O)Nc1ncccn1
ZINC000015856190
ZINC15856190
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