Vitas-M small molecule compound

N-[2-methyl-5-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzyl]cyclohexanecarboxamide

Catalog ID
STK597511
SMILES O=C(C1CCCCC1)NCc1cc(ccc1C)c1nnc2n1nc(C)c1c2cccc1

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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 C25H27N5O MW 413.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N5O/c1-16-12-13-19(14-20(16)15-26-25(31)18-8-4-3-5-9-18)23-27-28-24-22-11-7-6-10-21(22)17(2)29-30(23)24/h6-7,10-14,18H,3-5,8-9,15H2,1-2H3,(H,26,31)
InChIKey
AQEAVRMRYFAQAV-UHFFFAOYSA-N
Synonyms
900883-65-0
900883650
CC1=C(C=C(C=C1)C2=NN=C3N2N=C(C4=CC=CC=C43)C)CNC(=O)C5CCCCC5
InChI=1SC25H27N5Oc116121319(1420(16)152625(31)188435918)232728242211761021(22)17(2)2930(23)24h67101418H358915H212H3(H2631)
MFCD06779005
N((2METHYL5(6METHYL(124)TRIAZOLO(34A)PHTHALAZIN3YL)PHENYL)METHYL)CYCLOHEXANECARBOXAMIDE
N(2methyl5(6methyl(124)triazolo(34a)phthalazin3yl)benzyl)cyclohexanecarboxamide
ZINC000005304108
ZINC05304108
ZINC5304108

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Available files

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