Vitas-M small molecule compound
4-({(E)-[1-(3,4-dimethylphenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-3-methoxy-N-phenylbenzenesulfonamide
Catalog ID
STL294907
SMILES COc1cc(ccc1N/C=C/1\C(=NN(C1=O)c1ccc(c(c1)C)C)C)S(=O)(=O)Nc1ccccc1
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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 C26H26N4O4S MW 490.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O4S/c1-17-10-11-21(14-18(17)2)30-26(31)23(19(3)28-30)16-27-24-13-12-22(15-25(24)34-4)35(32,33)29-20-8-6-5-7-9-20/h5-16,27,29H,1-4H3/b23-16+InChIKey
UTIUIRXSTHKGLO-XQNSMLJCSA-NSynonyms
4(((E)(1(34dimethylphenyl)3methyl5oxo15dihydro4Hpyrazol4ylidene)methyl)amino)3methoxyNphenylbenzenesulfonamide
4(((E)(1(34dimethylphenyl)3methyl5oxopyrazol4ylidene)methyl)amino)3methoxyNphenylbenzenesulfonamide
CC1=C(C=C(C=C1)N2C(=O)C(=CNC3=C(C=C(C=C3)S(=O)(=O)NC4=CC=CC=C4)OC)C(=N2)C)C
COc1cc(ccc1NC=C1C(=NN(C1=O)c1ccc(c(c1)C)C)C)S(=O)(=O)Nc1ccccc1
InChI=1SC26H26N4O4Sc117101121(1418(17)2)3026(31)23(19(3)2830)162724131222(1525(24)344)35(3233)29208657920h5162729H14H3b2316+
MFCD28032822
ZINC000101124933
ZINC08440257
ZINC101124933
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