Vitas-M small molecule compound
4-({(E)-[1-(4-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-N-(5-methoxypyrimidin-4-yl)benzenesulfonamide
Catalog ID
STL295522
SMILES COc1cncnc1NS(=O)(=O)c1ccc(cc1)N/C=C/1\C(=NN(C1=O)c1ccc(cc1)Cl)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 C22H19ClN6O4S MW 498.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClN6O4S/c1-14-19(22(30)29(27-14)17-7-3-15(23)4-8-17)11-25-16-5-9-18(10-6-16)34(31,32)28-21-20(33-2)12-24-13-26-21/h3-13,25H,1-2H3,(H,24,26,28)/b19-11+InChIKey
HOKSVGXPQSTNNY-YBFXNURJSA-NSynonyms
4(((E)(1(4chlorophenyl)3methyl5oxo15dihydro4Hpyrazol4ylidene)methyl)amino)N(5methoxypyrimidin4yl)benzenesulfonamide
4(((E)(1(4chlorophenyl)3methyl5oxopyrazol4ylidene)methyl)amino)N(5methoxypyrimidin4yl)benzenesulfonamide
CC1=NN(C(=O)C1=CNC2=CC=C(C=C2)S(=O)(=O)NC3=NC=NC=C3OC)C4=CC=C(C=C4)Cl
COc1cncnc1NS(=O)(=O)c1ccc(cc1)NC=C1C(=NN(C1=O)c1ccc(cc1)Cl)C
InChI=1SC22H19ClN6O4Sc11419(22(30)29(2714)177315(23)4817)1125165918(10616)34(3132)282120(332)1224132621h31325H12H3(H242628)b1911+
MFCD28033008
ZINC000101114202
ZINC101114202
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