Vitas-M small molecule compound
4-amino-6-(3-chlorophenyl)spiro[3-azabicyclo[3.1.0]hex-3-ene-2,2'-[1,3]dioxolane]-1,5-dicarbonitrile
Catalog ID
STK523687
SMILES N#CC12C(C2(C#N)C(=NC21OCCO2)N)c1cccc(c1)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 C15H11ClN4O2 MW 314.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11ClN4O2/c16-10-3-1-2-9(6-10)11-13(7-17)12(19)20-15(14(11,13)8-18)21-4-5-22-15/h1-3,6,11H,4-5H2,(H2,19,20)InChIKey
PISFUCYYRBHJCB-UHFFFAOYSA-NSynonyms
2AMINO6(3CHLOROPHENYL)SPIRO(13DIOXOLANE243AZABICYCLO(310)HEX2ENE)15DICARBONITRILE
4amino6(3chlorophenyl)spiro(13dioxolane223azabicyclo(310)hex3ene)15dicarbonitrile
4amino6(3chlorophenyl)spiro(3azabicyclo(310)hex3ene22(13)dioxolane)15dicarbonitrile
C1COC2(O1)C3(C(C3(C(=N2)N)C#N)C4=CC(=CC=C4)Cl)C#N
InChI=1SC15H11ClN4O2c16103129(610)1113(717)12(19)2015(14(1113)818)21452215h13611H45H2(H21920)
MFCD04096615
ZINC000015319185
ZINC000100157834
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