Vitas-M small molecule compound

(5Z)-5-[(cyclopropylamino)methylidene]-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxypyrimidine-2,4(3H,5H)-dione

Catalog ID
STL057659
SMILES COc1ccc(cc1OC)CCN1C(=O)N=C(/C(=C/NC2CC2)/C1=O)O

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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 C18H21N3O5 MW 359.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N3O5/c1-25-14-6-3-11(9-15(14)26-2)7-8-21-17(23)13(10-19-12-4-5-12)16(22)20-18(21)24/h3,6,9-10,12,19H,4-5,7-8H2,1-2H3,(H,20,22,24)/b13-10-
InChIKey
NWMLFLXMATVHML-RAXLEYEMSA-N
Synonyms

(5Z)5((CYCLOPROPYLAMINO)METHYLIDENE)1(2(34DIMETHOXYPHENYL)ETHYL)13DIAZINANE246TRIONE
(5Z)5((cyclopropylamino)methylidene)3(2(34dimethoxyphenyl)ethyl)6hydroxypyrimidine24(3H5H)dione
COC1=C(C=C(C=C1)CCN2C(=O)C(=CNC3CC3)C(=O)NC2=O)OC
COc1ccc(cc1OC)CCN1C(=O)N=C(C(=CNC2CC2)C1=O)O
InChI=1SC18H21N3O5c125146311(915(14)262)782117(23)13(1019124512)16(22)2018(21)24h369101219H4578H212H3(H202224)b1310
MFCD05724398
ZINC000005703478
ZINC5703478

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Available files

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