Vitas-M small molecule compound

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

Catalog ID
STL070924
SMILES CCOc1ccc(cc1OC)C1C(=C(N)Oc2c1c(=O)n(c(c2)C)CCCn1cncc1)C#N

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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 C25H27N5O4 MW 461.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N5O4/c1-4-33-19-7-6-17(13-20(19)32-3)22-18(14-26)24(27)34-21-12-16(2)30(25(31)23(21)22)10-5-9-29-11-8-28-15-29/h6-8,11-13,15,22H,4-5,9-10,27H2,1-3H3
InChIKey
WQIRXEVLZVFZRZ-UHFFFAOYSA-N
Synonyms
880794-55-8
2amino4(4ethoxy3methoxyphenyl)6(3(1Himidazol1yl)propyl)7methyl5oxo56dihydro4Hpyrano(32c)pyridine3carbonitrile
2AMINO4(4ETHOXY3METHOXYPHENYL)6(3IMIDAZOL1YLPROPYL)7METHYL5OXO4HPYRANO(32C)PYRIDINE3CARBONITRILE
2AMINO4(4ETHOXY3METHOXYPHENYL)6(3IMIDAZOLYLPROPYL)7METHYL5OXO6HYDRO4HPYRANO(32C)PYRIDINE3CARBONITRILE
6(3(1HIMIDAZOL1YL)PROPYL)2AMINO4(4ETHOXY3METHOXYPHENYL)7METHYL5OXO56DIHYDRO4HPYRANO(32C)PYRIDINE3CARBONITRILE
880794558
CCOC1=C(C=C(C=C1)C2C(=C(OC3=C2C(=O)N(C(=C3)C)CCCN4C=CN=C4)N)C#N)OC
InChI=1SC25H27N5O4c1433197617(1320(19)323)2218(1426)24(27)34211216(2)30(25(31)23(21)22)105929118281529h6811131522H4591027H213H3
MFCD06606436
ZINC000009124176
ZINC000009124177

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Available files

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