Vitas-M small molecule compound
N-[2-{(2E)-2-[(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]hydrazinyl}-2-oxo-1-(4-oxo-3,4-dihydrophthalazin-1-yl)ethyl]benzamide
Catalog ID
STL044824
SMILES O=C(c1ccccc1)NC(c1n[nH]c(=O)c2c1cccc2)C(=O)N/N=C/c1c(C)nn(c1Cl)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 C28H22ClN7O3 MW 539.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22ClN7O3/c1-17-22(25(29)36(35-17)19-12-6-3-7-13-19)16-30-33-28(39)24(31-26(37)18-10-4-2-5-11-18)23-20-14-8-9-15-21(20)27(38)34-32-23/h2-16,24H,1H3,(H,31,37)(H,33,39)(H,34,38)/b30-16+InChIKey
WCSUTFCGMDJJOZ-OKCVXOCRSA-NSynonyms
CC1=NN(C(=C1C=NNC(=O)C(C2=NNC(=O)C3=CC=CC=C32)NC(=O)C4=CC=CC=C4)Cl)C5=CC=CC=C5
InChI=1SC28H22ClN7O3c11722(25(29)36(3517)19126371319)16303328(39)24(3126(37)18104251118)232014891521(20)27(38)343223h21624H1H3(H3137)(H3339)(H3438)b3016+
MFCD03801144
N(2((2E)2((5chloro3methyl1phenyl1Hpyrazol4yl)methylidene)hydrazinyl)2oxo1(4oxo34dihydrophthalazin1yl)ethyl)benzamide
N(2((2E)2((5chloro3methyl1phenylpyrazol4yl)methylidene)hydrazinyl)2oxo1(4oxo3Hphthalazin1yl)ethyl)benzamide
O=C(c1ccccc1)NC(c1n(nH)c(=O)c2c1cccc2)C(=O)NN=Cc1c(C)nn(c1Cl)c1ccccc1
ZINC000001771800
ZINC000001771803
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