Vitas-M small molecule compound

6-amino-8-(3-bromo-4,5-diethoxyphenyl)-8H-[1,3]dioxolo[4,5-g]chromene-7-carbonitrile

Catalog ID
STK115531
SMILES CCOc1cc(cc(c1OCC)Br)C1C(=C(N)Oc2c1cc1OCOc1c2)C#N

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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 C21H19BrN2O5 MW 459.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrN2O5/c1-3-25-18-6-11(5-14(22)20(18)26-4-2)19-12-7-16-17(28-10-27-16)8-15(12)29-21(24)13(19)9-23/h5-8,19H,3-4,10,24H2,1-2H3
InChIKey
HKSWVIUOFIGXGW-UHFFFAOYSA-N
Synonyms

6AMINO8(3BROMO45DIETHOXYPHENYL)8H(13)DIOXOLO(45G)CHROMENE7CARBONITRILE
CCOC1=C(C(=CC(=C1)C2C3=CC4=C(C=C3OC(=C2C#N)N)OCO4)Br)OCC
InChI=1SC21H19BrN2O5c132518611(514(22)20(18)2642)191271617(28102716)815(12)2921(24)13(19)923h5819H341024H212H3
MFCD04128550
ZINC000009296361
ZINC000009296362

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Available files

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