Vitas-M small molecule compound
ethyl 4-{[(3-{[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl}-1-ethyl-1H-pyrazol-4-yl)carbonyl]amino}benzoate
Catalog ID
STL133032
SMILES CCOC(=O)c1ccc(cc1)NC(=O)c1cn(nc1S(=O)(=O)N1CCN(CC1)c1cccc(c1C)C)CC
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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 C27H33N5O5S MW 539.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33N5O5S/c1-5-31-18-23(25(33)28-22-12-10-21(11-13-22)27(34)37-6-2)26(29-31)38(35,36)32-16-14-30(15-17-32)24-9-7-8-19(3)20(24)4/h7-13,18H,5-6,14-17H2,1-4H3,(H,28,33)InChIKey
VCZFPHIMGNMDEZ-UHFFFAOYSA-NSynonyms
CCN1C=C(C(=N1)S(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3C)C)C(=O)NC4=CC=C(C=C4)C(=O)OCC
ethyl4(((3((4(23dimethylphenyl)piperazin1yl)sulfonyl)1ethyl1Hpyrazol4yl)carbonyl)amino)benzoate
ethyl4((3(4(23dimethylphenyl)piperazin1yl)sulfonyl1ethylpyrazole4carbonyl)amino)benzoate
InChI=1SC27H33N5O5Sc15311823(25(33)2822121021(111322)27(34)3762)26(2931)38(3536)32161430(151732)2497819(3)20(24)4h71318H561417H214H3(H2833)
MFCD20752975
ZINC000102921123
ZINC102921123
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