Vitas-M small molecule compound
4,4'-[(3-chloro-4,5-diethoxyphenyl)methanediyl]bis(1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one)
Catalog ID
STK509275
SMILES CCOc1cc(cc(c1OCC)Cl)C(c1c(=O)n(n(c1C)C)c1ccccc1)c1c(=O)n(n(c1C)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 C33H35ClN4O4 MW 587.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H35ClN4O4/c1-7-41-27-20-23(19-26(34)31(27)42-8-2)30(28-21(3)35(5)37(32(28)39)24-15-11-9-12-16-24)29-22(4)36(6)38(33(29)40)25-17-13-10-14-18-25/h9-20,30H,7-8H2,1-6H3InChIKey
JVCFRVMINOETMX-UHFFFAOYSA-NSynonyms
4((3chloro45diethoxyphenyl)(15dimethyl3oxo2phenylpyrazol4yl)methyl)15dimethyl2phenylpyrazol3one
44((3chloro45diethoxyphenyl)methanediyl)bis(15dimethyl2phenyl12dihydro3Hpyrazol3one)
CCOC1=C(C(=CC(=C1)C(C2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C4=C(N(N(C4=O)C5=CC=CC=C5)C)C)Cl)OCC
InChI=1SC33H35ClN4O4c1741272023(1926(34)31(27)4282)30(2821(3)35(5)37(32(28)39)2415119121624)2922(4)36(6)38(33(29)40)25171310141825h92030H78H216H3
MFCD04230794
ZINC000101010958
ZINC101010958
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