Vitas-M small molecule compound
(4E)-4-{[1-(3-chloro-2-methylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK160406
SMILES CC1=NN(C(=O)/C/1=C/c1cc(n(c1C)c1cccc(c1C)Cl)C)c1ccccc1
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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 C24H22ClN3O MW 403.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22ClN3O/c1-15-13-19(18(4)27(15)23-12-8-11-22(25)16(23)2)14-21-17(3)26-28(24(21)29)20-9-6-5-7-10-20/h5-14H,1-4H3/b21-14+InChIKey
VALDTVAMDXZMLG-KGENOOAVSA-NSynonyms
(4E)4((1(3CHLORO2METHYLPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)5METHYL2PHENYL24DIHYDRO3HPYRAZOL3ONE
(4E)4((1(3CHLORO2METHYLPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)5METHYL2PHENYLPYRAZOL3ONE
CC1=CC(=C(N1C2=C(C(=CC=C2)Cl)C)C)C=C3C(=NN(C3=O)C4=CC=CC=C4)C
CC1=NN(C(=O)C1=Cc1cc(n(c1C)c1cccc(c1C)Cl)C)c1ccccc1
InChI=1SC24H22ClN3Oc1151319(18(4)27(15)231281122(25)16(23)2)142117(3)2628(24(21)29)2096571020h514H14H3b2114+
MFCD04521450
ZINC000001144136
ZINC01144136
ZINC1144136
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