Vitas-M small molecule compound
4-({(E)-[1-(4-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-3-methoxy-N-(2-methylphenyl)benzenesulfonamide
Catalog ID
STL295861
SMILES COc1cc(ccc1N/C=C/1\C(=NN(C1=O)c1ccc(cc1)Cl)C)S(=O)(=O)Nc1ccccc1C
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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 C25H23ClN4O4S MW 511.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23ClN4O4S/c1-16-6-4-5-7-22(16)29-35(32,33)20-12-13-23(24(14-20)34-3)27-15-21-17(2)28-30(25(21)31)19-10-8-18(26)9-11-19/h4-15,27,29H,1-3H3/b21-15+InChIKey
KABWUJBAKABDJY-RCCKNPSSSA-NSynonyms
4(((E)(1(4chlorophenyl)3methyl5oxo15dihydro4Hpyrazol4ylidene)methyl)amino)3methoxyN(2methylphenyl)benzenesulfonamide
4(((E)(1(4CHLOROPHENYL)3METHYL5OXOPYRAZOL4YLIDENE)METHYL)AMINO)3METHOXYN(2METHYLPHENYL)BENZENESULFONAMIDE
CC1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)NC=C3C(=NN(C3=O)C4=CC=C(C=C4)Cl)C)OC
COc1cc(ccc1NC=C1C(=NN(C1=O)c1ccc(cc1)Cl)C)S(=O)(=O)Nc1ccccc1C
InChI=1SC25H23ClN4O4Sc116645722(16)2935(3233)20121323(24(1420)343)27152117(2)2830(25(21)31)1910818(26)91119h4152729H13H3b2115+
MFCD28033191
ZINC000101129194
ZINC08440274
ZINC101129194
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