Vitas-M small molecule compound
4-amino-5'-fluoro-2'-oxo-1',2',6,7-tetrahydrospiro[1,3-dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-2,3'-indole]-3-carbonitrile
Catalog ID
STK590385
SMILES N#CC1=C(N)N2CCc3c(C2=CC21C(=O)Nc1c2cc(F)cc1)cc1c(c3)OCO1
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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 C22H15FN4O3 MW 402.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15FN4O3/c23-12-1-2-16-14(6-12)22(21(28)26-16)8-17-13-7-19-18(29-10-30-19)5-11(13)3-4-27(17)20(25)15(22)9-24/h1-2,5-8H,3-4,10,25H2,(H,26,28)InChIKey
AWTVHQPMVBKGPN-UHFFFAOYSA-NSynonyms
898916-32-04amino5fluoro2oxo1267tetrahydrospiro(13dioxolo(45g)pyrido(21a)isoquinoline23indole)3carbonitrile
4amino5fluoro2oxo67dihydrospiro((13)dioxolo(45g)pyrido(21a)isoquinoline23indoline)3carbonitrile
4amino5fluoro2oxospiro(1Hindole3267dihydro(13)benzodioxolo(65a)quinolizine)3carbonitrile
898916320
C1CN2C(=CC3(C4=C(C=CC(=C4)F)NC3=O)C(=C2N)C#N)C5=CC6=C(C=C51)OCO6
InChI=1SC22H15FN4O3c2312121614(612)22(21(28)2616)8171371918(29103019)511(13)3427(17)20(25)15(22)924h1258H341025H2(H2628)
MFCD07638437
ZINC000005355012
ZINC000005355016
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