Vitas-M small molecule compound
ethyl [3-(2-amino-3-cyano-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromen-4-yl)-1H-indol-1-yl]acetate
Catalog ID
STL371475
SMILES CCOC(=O)Cn1cc(c2c1cccc2)C1C(=C(N)OC2=C1C(=O)CC(C2)(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 C24H25N3O4 MW 419.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O4/c1-4-30-20(29)13-27-12-16(14-7-5-6-8-17(14)27)21-15(11-25)23(26)31-19-10-24(2,3)9-18(28)22(19)21/h5-8,12,21H,4,9-10,13,26H2,1-3H3InChIKey
CPTNFKQUMMWOCK-UHFFFAOYSA-NSynonyms
CCOC(=O)CN1C=C(C2=CC=CC=C21)C3C(=C(OC4=C3C(=O)CC(C4)(C)C)N)C#N
ethyl(3(2amino3cyano77dimethyl5oxo5678tetrahydro4Hchromen4yl)1Hindol1yl)acetate
ETHYL2(3(2AMINO3CYANO77DIMETHYL5OXO4H678TRIHYDROCHROMEN4YL)INDOLYL)ACETATE
ETHYL2(3(2AMINO3CYANO77DIMETHYL5OXO68DIHYDRO4HCHROMEN4YL)INDOL1YL)ACETATE
InChI=1SC24H25N3O4c143020(29)13271216(14756817(14)27)2115(1125)23(26)31191024(23)918(28)22(19)21h581221H49101326H213H3
MFCD05819126
ZINC000000818725
ZINC000000818726
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