Vitas-M small molecule compound
6-amino-8-{4-[(2-cyanobenzyl)oxy]-3-ethoxyphenyl}-8H-[1,3]dioxolo[4,5-g]chromene-7-carbonitrile
Catalog ID
STK117280
SMILES CCOc1cc(ccc1OCc1ccccc1C#N)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 C27H21N3O5 MW 467.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21N3O5/c1-2-31-23-9-16(7-8-21(23)32-14-18-6-4-3-5-17(18)12-28)26-19-10-24-25(34-15-33-24)11-22(19)35-27(30)20(26)13-29/h3-11,26H,2,14-15,30H2,1H3InChIKey
YUYLGUVOCBRVPB-UHFFFAOYSA-NSynonyms
6AMINO8(4((2CYANOBENZYL)OXY)3ETHOXYPHENYL)8H(13)DIOXOLO(45G)CHROMENE7CARBONITRILE
6AMINO8(4((2CYANOPHENYL)METHOXY)3ETHOXYPHENYL)8H(13)DIOXOLO(45G)CHROMENE7CARBONITRILE
CCOC1=C(C=CC(=C1)C2C3=CC4=C(C=C3OC(=C2C#N)N)OCO4)OCC5=CC=CC=C5C#N
InChI=1SC27H21N3O5c123123916(7821(23)321418643517(18)1228)2619102425(34153324)1122(19)3527(30)20(26)1329h31126H2141530H21H3
MFCD04128494
ZINC000009805454
ZINC000012629287
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