Vitas-M small molecule compound
2-amino-4-{4-[(2-bromophenoxy)methyl]-5-methylthiophen-2-yl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STL175526
SMILES N#CC1=C(N)OC2=C(C1c1sc(c(c1)COc1ccccc1Br)C)C(=O)CCC2
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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 C22H19BrN2O3S MW 471.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19BrN2O3S/c1-12-13(11-27-17-7-3-2-5-15(17)23)9-19(29-12)20-14(10-24)22(25)28-18-8-4-6-16(26)21(18)20/h2-3,5,7,9,20H,4,6,8,11,25H2,1H3InChIKey
DZXKTPFLYBKHPJ-UHFFFAOYSA-NSynonyms
438215-04-42amino4(4((2bromophenoxy)methyl)5methylthiophen2yl)5oxo4678tetrahydrochromene3carbonitrile
2amino4(4((2bromophenoxy)methyl)5methylthiophen2yl)5oxo5678tetrahydro4Hchromene3carbonitrile
438215044
CC1=C(C=C(S1)C2C(=C(OC3=C2C(=O)CCC3)N)C#N)COC4=CC=CC=C4Br
InChI=1SC22H19BrN2O3Sc11213(112717732515(17)23)919(2912)2014(1024)22(25)281884616(26)21(18)20h2357920H4681125H21H3
MFCD03074087
ZINC000000650560
ZINC000002735671
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