Vitas-M small molecule compound

ethyl {2-[N'-(5-chloro-2-methoxyphenyl)carbamimidamido]-6-oxo-1,6-dihydropyrimidin-4-yl}acetate

Catalog ID
STK282318
SMILES CCOC(=O)Cc1cc(=O)[nH]c(n1)NC(=N)Nc1cc(Cl)ccc1OC

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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 C16H18ClN5O4 MW 379.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18ClN5O4/c1-3-26-14(24)8-10-7-13(23)21-16(19-10)22-15(18)20-11-6-9(17)4-5-12(11)25-2/h4-7H,3,8H2,1-2H3,(H4,18,19,20,21,22,23)
InChIKey
PCFOAZURYRWOMV-UHFFFAOYSA-N
Synonyms

CCOC(=O)CC1=CC(=O)N=C(N1)N=C(N)NC2=C(C=CC(=C2)Cl)OC
CCOC(=O)Cc1cc(=O)(nH)c(n1)NC(=N)Nc1cc(Cl)ccc1OC
ethyl(2(N(5chloro2methoxyphenyl)carbamimidamido)6oxo16dihydropyrimidin4yl)acetate
ethyl2(2((amino(5chloro2methoxyanilino)methylidene)amino)4oxo1Hpyrimidin6yl)acetate
InChI=1SC16H18ClN5O4c132614(24)810713(23)2116(1910)2215(18)201169(17)4512(11)252h47H38H212H3(H4181920212223)
MFCD08709150
ZINC000019939718
ZINC19939718

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Available files

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