Vitas-M small molecule compound

4-amino-6-[4-(benzyloxy)phenyl]spiro[3-azabicyclo[3.1.0]hex-3-ene-2,2'-[1,3]dioxolane]-1,5-dicarbonitrile

Catalog ID
STK523699
SMILES N#CC12C(C2(C#N)C(=NC21OCCO2)N)c1ccc(cc1)OCc1ccccc1

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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 C22H18N4O3 MW 386.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N4O3/c23-13-20-18(21(20,14-24)22(26-19(20)25)28-10-11-29-22)16-6-8-17(9-7-16)27-12-15-4-2-1-3-5-15/h1-9,18H,10-12H2,(H2,25,26)
InChIKey
YCTIMKSFVNOLLE-UHFFFAOYSA-N
Synonyms

2AMINO6(4PHENYLMETHOXYPHENYL)SPIRO(13DIOXOLANE243AZABICYCLO(310)HEX2ENE)15DICARBONITRILE
4amino6(4(benzyloxy)phenyl)spiro(3azabicyclo(310)hex3ene22(13)dioxolane)15dicarbonitrile
4amino6(4phenylmethoxyphenyl)spiro(13dioxolane223azabicyclo(310)hex3ene)15dicarbonitrile
C1COC2(O1)C3(C(C3(C(=N2)N)C#N)C4=CC=C(C=C4)OCC5=CC=CC=C5)C#N
InChI=1SC22H18N4O3c23132018(21(201424)22(2619(20)25)2810112922)166817(9716)2712154213515h1918H1012H2(H22526)
MFCD04096809
ZINC000015021466
ZINC000100205212

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Available files

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