Vitas-M small molecule compound
methyl (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
STK863606
SMILES COC(=O)CN1c2ccccc2C2(C1=O)C(=C(N)OC1=C2C(=O)CC(C1)(C)C)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 C22H21N3O5 MW 407.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O5/c1-21(2)8-15(26)18-16(9-21)30-19(24)13(10-23)22(18)12-6-4-5-7-14(12)25(20(22)28)11-17(27)29-3/h4-7H,8-9,11,24H2,1-3H3InChIKey
HMAAEUFHJLLLBP-UHFFFAOYSA-NSynonyms
445222-68-4445222684
CC1(CC2=C(C(=O)C1)C3(C4=CC=CC=C4N(C3=O)CC(=O)OC)C(=C(O2)N)C#N)C
InChI=1SC22H21N3O5c121(2)815(26)1816(921)3019(24)13(1023)22(18)12645714(12)25(20(22)28)1117(27)293h47H891124H213H3
methyl(2amino3cyano77dimethyl25dioxo5678tetrahydrospiro(chromene43indol)1(2H)yl)acetate
methyl2(2amino3cyano77dimethyl25dioxo5678tetrahydrospiro(chromene43indolin)1yl)acetate
METHYL2(2AMINO3CYANO77DIMETHYL25DIOXOSPIRO(68DIHYDROCHROMENE43INDOLE)1YL)ACETATE
MFCD02949217
ZINC000004110991
ZINC000004110993
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