Vitas-M small molecule compound

4-(2-amino-3-cyano-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromen-4-yl)-2-methoxyphenyl acetate

Catalog ID
STK375244
SMILES N#CC1=C(N)OC2=C(C1c1ccc(c(c1)OC)OC(=O)C)C(=O)CC(C2)(C)C

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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 C21H22N2O5 MW 382.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O5/c1-11(24)27-15-6-5-12(7-16(15)26-4)18-13(10-22)20(23)28-17-9-21(2,3)8-14(25)19(17)18/h5-7,18H,8-9,23H2,1-4H3
InChIKey
AMZSOPQZZZTALL-UHFFFAOYSA-N
Synonyms

(4(2AMINO3CYANO77DIMETHYL5OXO68DIHYDRO4HCHROMEN4YL)2METHOXYPHENYL)ACETATE
4(2AMINO3CYANO77DIMETHYL5OXO(4H678TRIHYDROCHROMEN4YL))2METHOXYPHENYLACETATE
4(2amino3cyano77dimethyl5oxo5678tetrahydro4Hchromen4yl)2methoxyphenylacetate
CC(=O)OC1=C(C=C(C=C1)C2C(=C(OC3=C2C(=O)CC(C3)(C)C)N)C#N)OC
InChI=1SC21H22N2O5c111(24)27156512(716(15)264)1813(1022)20(23)2817921(23)814(25)19(17)18h5718H8923H214H3
MFCD01119020
ZINC000000792613
ZINC000000792614

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Available files

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