Vitas-M small molecule compound
(9Z)-1-benzyl-9-[(2E)-(1-benzyl-3,6-diazatricyclo[4.3.1.1~3,8~]undec-9-ylidene)hydrazinylidene]-3,6-diazatricyclo[4.3.1.1~3,8~]undecane
Catalog ID
STK395454
SMILES c1ccc(cc1)CC12CN3CCN(C1)CC(/C/2=N\N=C/1\C2CN4CC1(CN(C2)CC4)Cc1ccccc1)C3
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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 C32H40N6 MW 508.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H40N6/c1-3-7-25(8-4-1)15-31-21-35-11-12-36(22-31)18-27(17-35)29(31)33-34-30-28-19-37-13-14-38(20-28)24-32(30,23-37)16-26-9-5-2-6-10-26/h1-10,27-28H,11-24H2/b33-29-,34-30+InChIKey
XCAOLZVVOKXBBD-HKQZHLORSA-NSynonyms
(9Z)1benzyl9((2E)(1benzyl36diazatricyclo(4311~38~)undec9ylidene)hydrazinylidene)36diazatricyclo(4311~38~)undecane
c1ccc(cc1)CC12CN3CCN(C1)CC(C2=NN=C1C2CN4CC1(CN(C2)CC4)Cc1ccccc1)C3
C1CN2CC3CN1CC(C2)(C3=NN=C4C5CN6CCN(C5)CC4(C6)CC7=CC=CC=C7)CC8=CC=CC=C8
InChI=1SC32H40N6c13725(841)15312135111236(2231)1827(1735)29(31)333430281937131438(2028)2432(302337)162695261026h1102728H1124H2b33293430+
MFCD01107266
ZINC000095483283
ZINC95483283
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