Vitas-M small molecule compound
(4E)-4-{[1-(3-iodophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK165360
SMILES Ic1cccc(c1)n1c(C)cc(c1C)/C=C/1\C(=NN(C1=O)c1ccccc1)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 C23H20IN3O MW 481.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20IN3O/c1-15-12-18(17(3)26(15)21-11-7-8-19(24)14-21)13-22-16(2)25-27(23(22)28)20-9-5-4-6-10-20/h4-14H,1-3H3/b22-13+InChIKey
CPSLFUJBRBQDGQ-LPYMAVHISA-NSynonyms
(4E)4((1(3IODOPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)5METHYL2PHENYL24DIHYDRO3HPYRAZOL3ONE
(4E)4((1(3IODOPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)5METHYL2PHENYLPYRAZOL3ONE
CC1=CC(=C(N1C2=CC(=CC=C2)I)C)C=C3C(=NN(C3=O)C4=CC=CC=C4)C
Ic1cccc(c1)n1c(C)cc(c1C)C=C1C(=NN(C1=O)c1ccccc1)C
InChI=1SC23H20IN3Oc1151218(17(3)26(15)21117819(24)1421)132216(2)2527(23(22)28)2095461020h414H13H3b2213+
MFCD04563141
ZINC000009259234
ZINC09259234
ZINC9259234
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