Vitas-M small molecule compound
6-amino-8-[4-(benzyloxy)-2-bromo-5-methoxyphenyl]-8H-[1,3]dioxolo[4,5-g]chromene-7-carbonitrile
Catalog ID
STK117295
SMILES N#CC1=C(N)Oc2c(C1c1cc(OC)c(cc1Br)OCc1ccccc1)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 C25H19BrN2O5 MW 507.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19BrN2O5/c1-29-20-7-15(18(26)9-22(20)30-12-14-5-3-2-4-6-14)24-16-8-21-23(32-13-31-21)10-19(16)33-25(28)17(24)11-27/h2-10,24H,12-13,28H2,1H3InChIKey
YBNJNQQOERNJNW-UHFFFAOYSA-NSynonyms
6AMINO8(2BROMO5METHOXY4PHENYLMETHOXYPHENYL)8H(13)DIOXOLO(45G)CHROMENE7CARBONITRILE
6AMINO8(4(BENZYLOXY)2BROMO5METHOXYPHENYL)8H(13)DIOXOLO(45G)CHROMENE7CARBONITRILE
COC1=C(C=C(C(=C1)C2C3=CC4=C(C=C3OC(=C2C#N)N)OCO4)Br)OCC5=CC=CC=C5
InChI=1SC25H19BrN2O5c12920715(18(26)922(20)3012145324614)241682123(32133121)1019(16)3325(28)17(24)1127h21024H121328H21H3
MFCD04128605
ZINC000009296367
ZINC000009296368
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