Vitas-M small molecule compound
2-amino-4-{4-[(4-bromophenoxy)methyl]-5-ethylthiophen-2-yl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STK956171
SMILES N#CC1=C(N)OC2=C(C1c1cc(c(s1)CC)COc1ccc(cc1)Br)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 C23H21BrN2O3S MW 485.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21BrN2O3S/c1-2-19-13(12-28-15-8-6-14(24)7-9-15)10-20(30-19)21-16(11-25)23(26)29-18-5-3-4-17(27)22(18)21/h6-10,21H,2-5,12,26H2,1H3InChIKey
SWXWHXIDFXHFAC-UHFFFAOYSA-NSynonyms
438223-43-92amino4(4((4bromophenoxy)methyl)5ethylthiophen2yl)5oxo4678tetrahydrochromene3carbonitrile
2amino4(4((4bromophenoxy)methyl)5ethylthiophen2yl)5oxo5678tetrahydro4Hchromene3carbonitrile
438223439
CCC1=C(C=C(S1)C2C(=C(OC3=C2C(=O)CCC3)N)C#N)COC4=CC=C(C=C4)Br
InChI=1SC23H21BrN2O3Sc121913(1228158614(24)7915)1020(3019)2116(1125)23(26)291853417(27)22(18)21h61021H251226H21H3
MFCD03074706
ZINC000001009252
ZINC000001009253
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