Vitas-M small molecule compound
2-(4-{(Z)-[1-(3-bromophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-methoxyphenoxy)-N-(4-methylphenyl)acetamide
Catalog ID
STL171806
SMILES COc1cc(ccc1OCC(=O)Nc1ccc(cc1)C)/C=C\1/C(=NN(C1=O)c1cccc(c1)Br)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 C27H24BrN3O4 MW 534.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24BrN3O4/c1-17-7-10-21(11-8-17)29-26(32)16-35-24-12-9-19(14-25(24)34-3)13-23-18(2)30-31(27(23)33)22-6-4-5-20(28)15-22/h4-15H,16H2,1-3H3,(H,29,32)/b23-13-InChIKey
LSKWZANSDMWUNO-QRVIBDJDSA-NSynonyms
355001-53-52(4((Z)(1(3bromophenyl)3methyl5oxo15dihydro4Hpyrazol4ylidene)methyl)2methoxyphenoxy)N(4methylphenyl)acetamide
2(4((Z)(1(3bromophenyl)3methyl5oxopyrazol4ylidene)methyl)2methoxyphenoxy)N(4methylphenyl)acetamide
355001535
CC1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)C=C3C(=NN(C3=O)C4=CC(=CC=C4)Br)C)OC
COc1cc(ccc1OCC(=O)Nc1ccc(cc1)C)C=C1C(=NN(C1=O)c1cccc(c1)Br)C
InChI=1SC27H24BrN3O4c11771021(11817)2926(32)16352412919(1425(24)343)132318(2)3031(27(23)33)2264520(28)1522h415H16H213H3(H2932)b2313
MFCD01835389
ZINC000100310580
ZINC100310580
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