Vitas-M small molecule compound
4-({(E)-[1-(3,4-dimethylphenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide
Catalog ID
STL294865
SMILES Cc1cc(C)nc(n1)NS(=O)(=O)c1ccc(cc1)N/C=C/1\C(=NN(C1=O)c1ccc(c(c1)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 C25H26N6O3S MW 490.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N6O3S/c1-15-6-9-21(12-16(15)2)31-24(32)23(19(5)29-31)14-26-20-7-10-22(11-8-20)35(33,34)30-25-27-17(3)13-18(4)28-25/h6-14,26H,1-5H3,(H,27,28,30)/b23-14+InChIKey
KXDSHINPCLDVPN-OEAKJJBVSA-NSynonyms
4(((E)(1(34dimethylphenyl)3methyl5oxo15dihydro4Hpyrazol4ylidene)methyl)amino)N(46dimethylpyrimidin2yl)benzenesulfonamide
4(((E)(1(34dimethylphenyl)3methyl5oxopyrazol4ylidene)methyl)amino)N(46dimethylpyrimidin2yl)benzenesulfonamide
CC1=C(C=C(C=C1)N2C(=O)C(=CNC3=CC=C(C=C3)S(=O)(=O)NC4=NC(=CC(=N4)C)C)C(=N2)C)C
Cc1cc(C)nc(n1)NS(=O)(=O)c1ccc(cc1)NC=C1C(=NN(C1=O)c1ccc(c(c1)C)C)C
InChI=1SC25H26N6O3Sc1156921(1216(15)2)3124(32)23(19(5)2931)14262071022(11820)35(3334)30252717(3)1318(4)2825h61426H15H3(H272830)b2314+
MFCD28032803
ZINC000013575833
ZINC13575833
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