Vitas-M small molecule compound
2-amino-4-(5-bromo-1H-indol-3-yl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STL360948
SMILES N#CC1=C(N)OC2=C(C1c1c[nH]c3c1cc(Br)cc3)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 C20H18BrN3O2 MW 412.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18BrN3O2/c1-20(2)6-15(25)18-16(7-20)26-19(23)12(8-22)17(18)13-9-24-14-4-3-10(21)5-11(13)14/h3-5,9,17,24H,6-7,23H2,1-2H3InChIKey
SUCZWFOPTUOYOL-UHFFFAOYSA-NSynonyms
370074-89-82amino4(5bromo1Hindol3yl)77dimethyl5oxo5678tetrahydro4Hchromene3carbonitrile
2AMINO4(5BROMO1HINDOL3YL)77DIMETHYL5OXO68DIHYDRO4HCHROMENE3CARBONITRILE
2AMINO4(5BROMOINDOL3YL)77DIMETHYL5OXO4H678TRIHYDROCHROMENE3CARBONITRILE
370074898
CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CNC4=C3C=C(C=C4)Br)C(=O)C1)C
InChI=1SC20H18BrN3O2c120(2)615(25)1816(720)2619(23)12(822)17(18)13924144310(21)511(13)14h3591724H6723H212H3
MFCD00601842
N#CC1=C(N)OC2=C(C1c1c(nH)c3c1cc(Br)cc3)C(=O)CC(C2)(C)C
ZINC000003204132
ZINC000003204134
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