Vitas-M small molecule compound

4-{(1Z)-1-[2-({4-[(4-bromophenyl)sulfonyl]piperazin-1-yl}acetyl)hydrazinylidene]ethyl}phenyl acetate

Catalog ID
STK999343
SMILES O=C(CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br)N/N=C(\c1ccc(cc1)OC(=O)C)/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 C22H25BrN4O5S MW 537.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25BrN4O5S/c1-16(18-3-7-20(8-4-18)32-17(2)28)24-25-22(29)15-26-11-13-27(14-12-26)33(30,31)21-9-5-19(23)6-10-21/h3-10H,11-15H2,1-2H3,(H,25,29)/b24-16-
InChIKey
LLGQXMLXWFKJRP-JLPGSUDCSA-N
Synonyms
488824-81-3
(4((Z)N((2(4(4BROMOPHENYL)SULFONYLPIPERAZIN1YL)ACETYL)AMINO)CMETHYLCARBONIMIDOYL)PHENYL)ACETATE
(Z)4(1(2(2(4((4bromophenyl)sulfonyl)piperazin1yl)acetyl)hydrazono)ethyl)phenylacetate
4((1Z)1(2((4((4bromophenyl)sulfonyl)piperazin1yl)acetyl)hydrazinylidene)ethyl)phenylacetate
488824813
CC(=NNC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=C(C=C3)OC(=O)C
InChI=1SC22H25BrN4O5Sc116(183720(8418)3217(2)28)242522(29)1526111327(141226)33(3031)219519(23)61021h310H1115H212H3(H2529)b2416
MFCD03293874
O=C(CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br)NN=C(c1ccc(cc1)OC(=O)C)C
ZINC000100856493
ZINC100858439

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Available files

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