Vitas-M small molecule compound
butyl 4-{[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)(4-methylphenyl)methyl]amino}benzoate
Catalog ID
STL321737
SMILES CCCCOC(=O)c1ccc(cc1)NC(c1c(C)n(n(c1=O)c1ccccc1)C)c1ccc(cc1)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 C30H33N3O3 MW 483.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33N3O3/c1-5-6-20-36-30(35)24-16-18-25(19-17-24)31-28(23-14-12-21(2)13-15-23)27-22(3)32(4)33(29(27)34)26-10-8-7-9-11-26/h7-19,28,31H,5-6,20H2,1-4H3InChIKey
NQAOKXRFZPPGOZ-UHFFFAOYSA-NSynonyms
371228-01-2371228012
butyl4(((15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)(4methylphenyl)methyl)amino)benzoate
butyl4(((15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)(ptolyl)methyl)amino)benzoate
BUTYL4(((15DIMETHYL3OXO2PHENYLPYRAZOL4YL)(4METHYLPHENYL)METHYL)AMINO)BENZOATE
CCCCOC(=O)C1=CC=C(C=C1)NC(C2=CC=C(C=C2)C)C3=C(N(N(C3=O)C4=CC=CC=C4)C)C
InChI=1SC30H33N3O3c156203630(35)24161825(191724)3128(23141221(2)131523)2722(3)32(4)33(29(27)34)26108791126h7192831H5620H214H3
MFCD01087841
ZINC000002285915
ZINC000002285916
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