Vitas-M small molecule compound
2-amino-4-{4-[(2,4-dichlorobenzyl)oxy]-3-iodo-5-methoxyphenyl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STL379697
SMILES N#CC1=C(N)OC2=C(C1c1cc(I)c(c(c1)OC)OCc1ccc(cc1Cl)Cl)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 C24H19Cl2IN2O4 MW 597.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19Cl2IN2O4/c1-31-20-8-13(7-17(27)23(20)32-11-12-5-6-14(25)9-16(12)26)21-15(10-28)24(29)33-19-4-2-3-18(30)22(19)21/h5-9,21H,2-4,11,29H2,1H3InChIKey
RBDBCPQJCKXFFO-UHFFFAOYSA-NSynonyms
2amino4(4((24dichlorobenzyl)oxy)3iodo5methoxyphenyl)5oxo5678tetrahydro4Hchromene3carbonitrile
2amino4(4((24dichlorophenyl)methoxy)3iodo5methoxyphenyl)5oxo4678tetrahydrochromene3carbonitrile
COC1=C(C(=CC(=C1)C2C(=C(OC3=C2C(=O)CCC3)N)C#N)I)OCC4=C(C=C(C=C4)Cl)Cl
InChI=1SC24H19Cl2IN2O4c13120813(717(27)23(20)3211125614(25)916(12)26)2115(1028)24(29)331942318(30)22(19)21h5921H241129H21H3
MFCD04210362
ZINC000001142102
ZINC000001142103
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