Vitas-M small molecule compound
6-amino-8-{3-chloro-4-[(2-fluorobenzyl)oxy]-5-methoxyphenyl}-8H-[1,3]dioxolo[4,5-g]chromene-7-carbonitrile
Catalog ID
STL375479
SMILES N#CC1=C(N)Oc2c(C1c1cc(Cl)c(c(c1)OC)OCc1ccccc1F)cc1c(c2)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 C25H18ClFN2O5 MW 480.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18ClFN2O5/c1-30-22-7-14(6-17(26)24(22)31-11-13-4-2-3-5-18(13)27)23-15-8-20-21(33-12-32-20)9-19(15)34-25(29)16(23)10-28/h2-9,23H,11-12,29H2,1H3InChIKey
DTKVFLJHHYZDOU-UHFFFAOYSA-NSynonyms
6amino8(3chloro4((2fluorobenzyl)oxy)5methoxyphenyl)8H(13)dioxolo(45g)chromene7carbonitrile
6AMINO8(3CHLORO4((2FLUOROPHENYL)METHOXY)5METHOXYPHENYL)8H(13)DIOXOLO(45G)CHROMENE7CARBONITRILE
COC1=C(C(=CC(=C1)C2C3=CC4=C(C=C3OC(=C2C#N)N)OCO4)Cl)OCC5=CC=CC=C5F
InChI=1SC25H18ClFN2O5c13022714(617(26)24(22)311113423518(13)27)231582021(33123220)919(15)3425(29)16(23)1028h2923H111229H21H3
MFCD03996877
ZINC000002837785
ZINC000002837786
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