Vitas-M small molecule compound
(4E)-5-{[(4-chlorophenyl)sulfanyl]methyl}-4-{[(4-methoxyphenyl)amino]methylidene}-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK781505
SMILES COc1ccc(cc1)N/C=C/1\C(=NN(C1=O)c1ccccc1)CSc1ccc(cc1)Cl
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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 C24H20ClN3O2S MW 449.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20ClN3O2S/c1-30-20-11-9-18(10-12-20)26-15-22-23(16-31-21-13-7-17(25)8-14-21)27-28(24(22)29)19-5-3-2-4-6-19/h2-15,26H,16H2,1H3/b22-15+InChIKey
HYYKKVKIIXTCSG-PXLXIMEGSA-NSynonyms
(4E)5(((4chlorophenyl)sulfanyl)methyl)4(((4methoxyphenyl)amino)methylidene)2phenyl24dihydro3Hpyrazol3one
(4E)5((4CHLOROPHENYL)SULFANYLMETHYL)4((4METHOXYANILINO)METHYLIDENE)2PHENYLPYRAZOL3ONE
COC1=CC=C(C=C1)NC=C2C(=NN(C2=O)C3=CC=CC=C3)CSC4=CC=C(C=C4)Cl
COc1ccc(cc1)NC=C1C(=NN(C1=O)c1ccccc1)CSc1ccc(cc1)Cl
InChI=1SC24H20ClN3O2Sc1302011918(101220)26152223(16312113717(25)81421)2728(24(22)29)195324619h21526H16H21H3b2215+
MFCD06015200
ZINC000100193173
ZINC100193173
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