Vitas-M small molecule compound

6-{(2E)-2-[3-chloro-5-ethoxy-4-(naphthalen-1-ylmethoxy)benzylidene]hydrazinyl}-N,N,N',N'-tetramethylpyrimidine-2,4-diamine

Catalog ID
STK531325
SMILES CCOc1cc(/C=N/Nc2cc(nc(n2)N(C)C)N(C)C)cc(c1OCc1cccc2c1cccc2)Cl

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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 C28H31ClN6O2 MW 519.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31ClN6O2/c1-6-36-24-15-19(17-30-33-25-16-26(34(2)3)32-28(31-25)35(4)5)14-23(29)27(24)37-18-21-12-9-11-20-10-7-8-13-22(20)21/h7-17H,6,18H2,1-5H3,(H,31,32,33)/b30-17+
InChIKey
HVHFNCBDJDWSNI-OCSSWDANSA-N
Synonyms

(E)6(2(3chloro5ethoxy4(naphthalen1ylmethoxy)benzylidene)hydrazinyl)N2N2N4N4tetramethylpyrimidine24diamine
3CHLORO5ETHOXY4(1NAPHTHYLMETHOXY)BENZALDEHYDE(26BIS(DIMETHYLAMINO)4PYRIMIDINYL)HYDRAZONE
6((2E)2(3chloro5ethoxy4(naphthalen1ylmethoxy)benzylidene)hydrazinyl)NNNNtetramethylpyrimidine24diamine
6N((E)(3chloro5ethoxy4(naphthalen1ylmethoxy)phenyl)methylideneamino)2N2N4N4Ntetramethylpyrimidine246triamine
CCOC1=C(C(=CC(=C1)C=NNC2=CC(=NC(=N2)N(C)C)N(C)C)Cl)OCC3=CC=CC4=CC=CC=C43
CCOc1cc(C=NNc2cc(nc(n2)N(C)C)N(C)C)cc(c1OCc1cccc2c1cccc2)Cl
InChI=1SC28H31ClN6O2c1636241519(173033251626(34(2)3)3228(3125)35(4)5)1423(29)27(24)371821129112010781322(20)21h717H618H215H3(H313233)b3017+
MFCD02952540
ZINC000008407742
ZINC34703857

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.