Vitas-M small molecule compound
ethyl 1-(3-bromophenyl)-5-{[(2E)-3-(1-ethyl-5-methyl-1H-pyrazol-4-yl)prop-2-enoyl]amino}-1H-pyrazole-4-carboxylate
Catalog ID
STK317483
SMILES CCOC(=O)c1cnn(c1NC(=O)/C=C/c1cnn(c1C)CC)c1cccc(c1)Br
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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 C21H22BrN5O3 MW 472.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22BrN5O3/c1-4-26-14(3)15(12-23-26)9-10-19(28)25-20-18(21(29)30-5-2)13-24-27(20)17-8-6-7-16(22)11-17/h6-13H,4-5H2,1-3H3,(H,25,28)/b10-9+InChIKey
HKDFYLCVTMKTBM-MDZDMXLPSA-NSynonyms
515850-13-2515850132
CCN1C(=C(C=N1)C=CC(=O)NC2=C(C=NN2C3=CC(=CC=C3)Br)C(=O)OCC)C
CCOC(=O)c1cnn(c1NC(=O)C=Cc1cnn(c1C)CC)c1cccc(c1)Br
ethyl1(3bromophenyl)5(((2E)3(1ethyl5methyl1Hpyrazol4yl)prop2enoyl)amino)1Hpyrazole4carboxylate
ETHYL1(3BROMOPHENYL)5(((E)3(1ETHYL5METHYLPYRAZOL4YL)PROP2ENOYL)AMINO)PYRAZOLE4CARBOXYLATE
InChI=1SC21H22BrN5O3c142614(3)15(122326)91019(28)252018(21(29)3052)132427(20)1786716(22)1117h613H45H213H3(H2528)b109+
MFCD02243536
ZINC000002769328
ZINC02769328
ZINC2769328
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