Vitas-M small molecule compound

N-(6-acetyl-1,3-benzodioxol-5-yl)-2-{2-[(3-fluorophenyl)amino]-4-methyl-6-oxopyrimidin-1(6H)-yl}acetamide

Catalog ID
STL080063
SMILES Fc1cccc(c1)Nc1nc(C)cc(=O)n1CC(=O)Nc1cc2OCOc2cc1C(=O)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 C22H19FN4O5 MW 438.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19FN4O5/c1-12-6-21(30)27(22(24-12)25-15-5-3-4-14(23)7-15)10-20(29)26-17-9-19-18(31-11-32-19)8-16(17)13(2)28/h3-9H,10-11H2,1-2H3,(H,24,25)(H,26,29)
InChIKey
HKTHKLYDXFNMQX-UHFFFAOYSA-N
Synonyms

CC1=CC(=O)N(C(=N1)NC2=CC(=CC=C2)F)CC(=O)NC3=CC4=C(C=C3C(=O)C)OCO4
InChI=1SC22H19FN4O5c112621(30)27(22(2412)251553414(23)715)1020(29)261791918(31113219)816(17)13(2)28h39H1011H212H3(H2425)(H2629)
MFCD18200829
N(6acetyl13benzodioxol5yl)2(2((3fluorophenyl)amino)4methyl6oxopyrimidin1(6H)yl)acetamide
N(6acetyl13benzodioxol5yl)2(2(3fluoroanilino)4methyl6oxopyrimidin1yl)acetamide
ZINC000057506380
ZINC57506380

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Available files

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