Vitas-M small molecule compound
4-{3-[(4-benzylpiperazin-1-yl)sulfonyl]-4-methylphenyl}-2-methylphthalazin-1(2H)-one
Catalog ID
STK878033
SMILES O=c1n(C)nc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)N1CCN(CC1)Cc1ccccc1)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 C27H28N4O3S MW 488.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O3S/c1-20-12-13-22(26-23-10-6-7-11-24(23)27(32)29(2)28-26)18-25(20)35(33,34)31-16-14-30(15-17-31)19-21-8-4-3-5-9-21/h3-13,18H,14-17,19H2,1-2H3InChIKey
XHRMSIXPEZPZEY-UHFFFAOYSA-NSynonyms
573669-76-84(3((4benzylpiperazin1yl)sulfonyl)4methylphenyl)2methylphthalazin1(2H)one
4(3(4BENZYLPIPERAZIN1YL)SULFONYL4METHYLPHENYL)2METHYLPHTHALAZIN1ONE
573669768
CC1=C(C=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)C)S(=O)(=O)N4CCN(CC4)CC5=CC=CC=C5
InChI=1SC27H28N4O3Sc120121322(262310671124(23)27(32)29(2)2826)1825(20)35(3334)31161430(151731)19218435921h31318H141719H212H3
MFCD04017394
ZINC000019214663
ZINC19214663
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