Vitas-M small molecule compound

2-amino-4-{2-[(2-chlorobenzyl)oxy]phenyl}-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile

Catalog ID
STK057809
SMILES N#CC1=C(N)Oc2c(C1c1ccccc1OCc1ccccc1Cl)c(=O)oc(c2)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 C23H17ClN2O4 MW 420.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17ClN2O4/c1-13-10-19-21(23(27)29-13)20(16(11-25)22(26)30-19)15-7-3-5-9-18(15)28-12-14-6-2-4-8-17(14)24/h2-10,20H,12,26H2,1H3
InChIKey
KDSALTXEZJYVKH-UHFFFAOYSA-N
Synonyms
309927-22-8
2amino4(2((2chlorobenzyl)oxy)phenyl)7methyl5oxo45dihydropyrano(43b)pyran3carbonitrile
2AMINO4(2((2CHLOROBENZYL)OXY)PHENYL)7METHYL5OXO4H5HPYRANO(43B)PYRAN3CARBONITRILE
2AMINO4(2((2CHLOROPHENYL)METHOXY)PHENYL)7METHYL5OXO4HPYRANO(32C)PYRAN3CARBONITRILE
309927228
CC1=CC2=C(C(C(=C(O2)N)C#N)C3=CC=CC=C3OCC4=CC=CC=C4Cl)C(=O)O1
InChI=1SC23H17ClN2O4c113101921(23(27)2913)20(16(1125)22(26)3019)15735918(15)281214624817(14)24h21020H1226H21H3
MFCD01605310
N#CC1=C(N)Oc2c(C1c1ccccc1OCc1ccccc1Cl)c(=O)oc(c2)C
STK057809
ZINC000001472197
ZINC000001472198

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Available files

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