Vitas-M small molecule compound
2-[5-(4-bromophenyl)-1-(phenylcarbonyl)-4,5-dihydro-1H-pyrazol-3-yl]-5-methoxyphenyl benzoate
Catalog ID
STL069613
SMILES COc1ccc(c(c1)OC(=O)c1ccccc1)C1=NN(C(C1)c1ccc(cc1)Br)C(=O)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 C30H23BrN2O4 MW 555.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23BrN2O4/c1-36-24-16-17-25(28(18-24)37-30(35)22-10-6-3-7-11-22)26-19-27(20-12-14-23(31)15-13-20)33(32-26)29(34)21-8-4-2-5-9-21/h2-18,27H,19H2,1H3InChIKey
PZPYANBQFUKYJF-UHFFFAOYSA-NSynonyms
(2(2BENZOYL3(4BROMOPHENYL)34DIHYDROPYRAZOL5YL)5METHOXYPHENYL)BENZOATE
2(1benzoyl5(4bromophenyl)45dihydro1Hpyrazol3yl)5methoxyphenylbenzoate
2(5(4bromophenyl)1(phenylcarbonyl)45dihydro1Hpyrazol3yl)5methoxyphenylbenzoate
COC1=CC(=C(C=C1)C2=NN(C(C2)C3=CC=C(C=C3)Br)C(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5
InChI=1SC30H23BrN2O4c13624161725(28(1824)3730(35)22106371122)261927(20121423(31)151320)33(3226)29(34)218425921h21827H19H21H3
MFCD03668808
ZINC000102816150
ZINC000102816153
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