Vitas-M small molecule compound
4-{4-methyl-3-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}-N-[3-(trifluoromethyl)phenyl]phthalazin-1-amine
Catalog ID
STK200856
SMILES CN1CCN(CC1)S(=O)(=O)c1cc(ccc1C)c1nnc(c2c1cccc2)Nc1cccc(c1)C(F)(F)F
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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 C27H26F3N5O2S MW 541.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26F3N5O2S/c1-18-10-11-19(16-24(18)38(36,37)35-14-12-34(2)13-15-35)25-22-8-3-4-9-23(22)26(33-32-25)31-21-7-5-6-20(17-21)27(28,29)30/h3-11,16-17H,12-15H2,1-2H3,(H,31,33)InChIKey
MGXBUWGPFOVJHI-UHFFFAOYSA-NSynonyms
371142-09-5371142095
4(4methyl3((4methylpiperazin1yl)sulfonyl)phenyl)N(3(trifluoromethyl)phenyl)phthalazin1amine
4(4METHYL3(4METHYLPIPERAZIN1YL)SULFONYLPHENYL)N(3(TRIFLUOROMETHYL)PHENYL)PHTHALAZIN1AMINE
CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=CC(=C4)C(F)(F)F)S(=O)(=O)N5CCN(CC5)C
InChI=1SC27H26F3N5O2Sc118101119(1624(18)38(3637)35141234(2)131535)2522834923(22)26(333225)312175620(1721)27(2829)30h3111617H1215H212H3(H3133)
MFCD03009227
ZINC97951320
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