Vitas-M small molecule compound
methyl (2-amino-3-cyano-2',5-dioxo-5,6,7,8-tetrahydrospiro[chromene-4,3'-indol]-1'(2'H)-yl)acetate
Catalog ID
STK863607
SMILES COC(=O)CN1c2ccccc2C2(C1=O)C(=C(N)OC1=C2C(=O)CCC1)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 C20H17N3O5 MW 379.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O5/c1-27-16(25)10-23-13-6-3-2-5-11(13)20(19(23)26)12(9-21)18(22)28-15-8-4-7-14(24)17(15)20/h2-3,5-6H,4,7-8,10,22H2,1H3InChIKey
XHHKBFRVDFSVAZ-UHFFFAOYSA-NSynonyms
445222-69-5445222695
COC(=O)CN1C2=CC=CC=C2C3(C1=O)C(=C(OC4=C3C(=O)CCC4)N)C#N
InChI=1SC20H17N3O5c12716(25)102313632511(13)20(19(23)26)12(921)18(22)281584714(24)17(15)20h2356H4781022H21H3
methyl(2amino3cyano25dioxo5678tetrahydrospiro(chromene43indol)1(2H)yl)acetate
methyl2(2amino3cyano25dioxo5678tetrahydrospiro(chromene43indolin)1yl)acetate
METHYL2(2AMINO3CYANO25DIOXOSPIRO(78DIHYDRO6HCHROMENE43INDOLE)1YL)ACETATE
MFCD02949218
ZINC000000989157
ZINC000000989158
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