Vitas-M small molecule compound

N-[N'-(3-chloro-4-fluorophenyl)-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]-2-(1,3-dioxooctahydro-2H-isoindol-2-yl)-3-phenylpropanamide

Catalog ID
STK559272
SMILES O=C(C(N1C(=O)C2C(C1=O)CCCC2)Cc1ccccc1)N/C(=N/c1ccc(c(c1)Cl)F)/Nc1nc(C)cc(n1)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 C30H30ClFN6O3 MW 577.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30ClFN6O3/c1-17-14-18(2)34-29(33-17)37-30(35-20-12-13-24(32)23(31)16-20)36-26(39)25(15-19-8-4-3-5-9-19)38-27(40)21-10-6-7-11-22(21)28(38)41/h3-5,8-9,12-14,16,21-22,25H,6-7,10-11,15H2,1-2H3,(H2,33,34,35,36,37,39)
InChIKey
KRJCAEGTKWPYPW-UHFFFAOYSA-N
Synonyms

MFCD04075002
O=C(C(N1C(=O)C2C(C1=O)CCCC2)Cc1ccccc1)NC(=Nc1ccc(c(c1)Cl)F)Nc1nc(C)cc(n1)C
ZINC000002593676
ZINC000239128729

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Available files

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