Vitas-M small molecule compound
benzyl (2-amino-3-cyano-7,7-dimethyl-2',5-dioxo-5,6,7,8-tetrahydrospiro[chromene-4,3'-indol]-1'(2'H)-yl)acetate
Catalog ID
STK863620
SMILES N#CC1=C(N)OC2=C(C31c1ccccc1N(C3=O)CC(=O)OCc1ccccc1)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 C28H25N3O5 MW 483.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O5/c1-27(2)12-21(32)24-22(13-27)36-25(30)19(14-29)28(24)18-10-6-7-11-20(18)31(26(28)34)15-23(33)35-16-17-8-4-3-5-9-17/h3-11H,12-13,15-16,30H2,1-2H3InChIKey
ZSVGDLZLYJVNJV-UHFFFAOYSA-NSynonyms
445223-02-9445223029
benzyl(2amino3cyano77dimethyl25dioxo5678tetrahydrospiro(chromene43indol)1(2H)yl)acetate
benzyl2(2amino3cyano77dimethyl25dioxo5678tetrahydrospiro(chromene43indolin)1yl)acetate
BENZYL2(2AMINO3CYANO77DIMETHYL25DIOXOSPIRO(68DIHYDROCHROMENE43INDOLE)1YL)ACETATE
CC1(CC2=C(C(=O)C1)C3(C4=CC=CC=C4N(C3=O)CC(=O)OCC5=CC=CC=C5)C(=C(O2)N)C#N)C
InChI=1SC28H25N3O5c127(2)1221(32)2422(1327)3625(30)19(1429)28(24)1810671120(18)31(26(28)34)1523(33)3516178435917h311H1213151630H212H3
MFCD03070484
ZINC000008448708
ZINC000008448709
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