Vitas-M small molecule compound

ethyl 4-({[4-(2,5-dimethylphenyl)-2,5-dioxo-3,4,5,7-tetrahydrofuro[3,4-d]pyrimidin-1(2H)-yl]acetyl}amino)benzoate

Catalog ID
STL128455
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CN1C(=O)NC(C2=C1COC2=O)c1cc(C)ccc1C

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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 C25H25N3O6 MW 463.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O6/c1-4-33-23(30)16-7-9-17(10-8-16)26-20(29)12-28-19-13-34-24(31)21(19)22(27-25(28)32)18-11-14(2)5-6-15(18)3/h5-11,22H,4,12-13H2,1-3H3,(H,26,29)(H,27,32)
InChIKey
NFZCPXYNMLCHPH-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C3=C(C(NC2=O)C4=C(C=CC(=C4)C)C)C(=O)OC3
ethyl4(((4(25dimethylphenyl)25dioxo3457tetrahydrofuro(34d)pyrimidin1(2H)yl)acetyl)amino)benzoate
ethyl4((2(4(25dimethylphenyl)25dioxo47dihydro3Hfuro(34d)pyrimidin1yl)acetyl)amino)benzoate
InChI=1SC25H25N3O6c143323(30)167917(10816)2620(29)122819133424(31)21(19)22(2725(28)32)181114(2)5615(18)3h51122H41213H213H3(H2629)(H2732)
MFCD20742052
ZINC000067288624
ZINC000067288627

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Available files

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