Vitas-M small molecule compound
4,4'-[(3-bromo-4-hydroxy-5-methoxyphenyl)methanediyl]bis(1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one)
Catalog ID
STK508923
SMILES COc1cc(cc(c1O)Br)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 C30H29BrN4O4 MW 589.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29BrN4O4/c1-18-25(29(37)34(32(18)3)21-12-8-6-9-13-21)27(20-16-23(31)28(36)24(17-20)39-5)26-19(2)33(4)35(30(26)38)22-14-10-7-11-15-22/h6-17,27,36H,1-5H3InChIKey
IVMNZGSDQPVWOJ-UHFFFAOYSA-NSynonyms
4((3BROMO4HYDROXY5METHOXYPHENYL)(15DIMETHYL3OXO2PHENYLPYRAZOL4YL)METHYL)15DIMETHYL2PHENYLPYRAZOL3ONE
44((3bromo4hydroxy5methoxyphenyl)methanediyl)bis(15dimethyl2phenyl12dihydro3Hpyrazol3one)
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C(C3=CC(=C(C(=C3)Br)O)OC)C4=C(N(N(C4=O)C5=CC=CC=C5)C)C
InChI=1SC30H29BrN4O4c11825(29(37)34(32(18)3)21128691321)27(201623(31)28(36)24(1720)395)2619(2)33(4)35(30(26)38)2214107111522h6172736H15H3
MFCD00845113
ZINC000008397157
ZINC08397157
ZINC8397157
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