Vitas-M small molecule compound
(4Z)-4-({[2-methoxy-4-(piperidin-1-ylsulfonyl)phenyl]amino}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL171436
SMILES COc1cc(ccc1N/C=C\1/C(=NN(C1=O)c1ccccc1)C)S(=O)(=O)N1CCCCC1
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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 C23H26N4O4S MW 454.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O4S/c1-17-20(23(28)27(25-17)18-9-5-3-6-10-18)16-24-21-12-11-19(15-22(21)31-2)32(29,30)26-13-7-4-8-14-26/h3,5-6,9-12,15-16,24H,4,7-8,13-14H2,1-2H3/b20-16-InChIKey
CNHURGLJEPASDF-SILNSSARSA-NSynonyms
(4Z)4(((2methoxy4(piperidin1ylsulfonyl)phenyl)amino)methylidene)5methyl2phenyl24dihydro3Hpyrazol3one
(4Z)4((2METHOXY4PIPERIDIN1YLSULFONYLANILINO)METHYLIDENE)5METHYL2PHENYLPYRAZOL3ONE
CC1=NN(C(=O)C1=CNC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)OC)C4=CC=CC=C4
COc1cc(ccc1NC=C1C(=NN(C1=O)c1ccccc1)C)S(=O)(=O)N1CCCCC1
InChI=1SC23H26N4O4Sc11720(23(28)27(2517)1895361018)162421121119(1522(21)312)32(2930)26137481426h356912151624H4781314H212H3b2016
MFCD01019516
ZINC000016671877
ZINC16671877
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