Vitas-M small molecule compound

methyl 2-amino-4-(2,4-dichlorophenyl)-6-[3-(1H-imidazol-1-yl)propyl]-7-methyl-5-oxo-5,6-dihydro-4H-pyrano[3,2-c]pyridine-3-carboxylate

Catalog ID
STK166681
SMILES COC(=O)C1=C(N)Oc2c(C1c1ccc(cc1Cl)Cl)c(=O)n(c(c2)C)CCCn1cncc1

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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 C23H22Cl2N4O4 MW 489.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22Cl2N4O4/c1-13-10-17-19(22(30)29(13)8-3-7-28-9-6-27-12-28)18(15-5-4-14(24)11-16(15)25)20(21(26)33-17)23(31)32-2/h4-6,9-12,18H,3,7-8,26H2,1-2H3
InChIKey
XLMCVWRHUTWKSL-UHFFFAOYSA-N
Synonyms
758700-49-1
758700491
CC1=CC2=C(C(C(=C(O2)N)C(=O)OC)C3=C(C=C(C=C3)Cl)Cl)C(=O)N1CCCN4C=CN=C4
InChI=1SC23H22Cl2N4O4c113101719(22(30)29(13)8372896271228)18(155414(24)1116(15)25)20(21(26)3317)23(31)322h4691218H37826H212H3
METHYL2AMINO4(24DICHLOROPHENYL)6(3(1HIMIDAZOL1YL)PROPYL)7METHYL5OXO56DIHYDRO4HPYRANO(32C)PYRIDINE3CARBOXYLATE
METHYL2AMINO4(24DICHLOROPHENYL)6(3IMIDAZOL1YLPROPYL)7METHYL5OXO4HPYRANO(32C)PYRIDINE3CARBOXYLATE
METHYL2AMINO4(24DICHLOROPHENYL)6(3IMIDAZOLYLPROPYL)7METHYL5OXO6HYDRO4HPYRANO(32C)PYRIDINE3CARBOXYLATE
METHYL6(3(1HIMIDAZOL1YL)PROPYL)2AMINO4(24DICHLOROPHENYL)7METHYL5OXO56DIHYDRO4HPYRANO(32C)PYRIDINE3CARBOXYLATE
MFCD06603600
ZINC000009123853
ZINC000009123958

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.