Vitas-M small molecule compound

ethyl {2-[N'-(3-chloro-2-methylphenyl)carbamimidamido]-6-oxo-1,6-dihydropyrimidin-4-yl}acetate

Catalog ID
STK203230
SMILES Cc1c(NC(=N)Nc2nc(CC(=O)OCC)cc(=O)[nH]2)cccc1Cl

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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 C16H18ClN5O3 MW 363.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18ClN5O3/c1-3-25-14(24)8-10-7-13(23)21-16(19-10)22-15(18)20-12-6-4-5-11(17)9(12)2/h4-7H,3,8H2,1-2H3,(H4,18,19,20,21,22,23)
InChIKey
RDQZDRPIBHVFBZ-UHFFFAOYSA-N
Synonyms

Cc1c(NC(=N)Nc2nc(CC(=O)OCC)cc(=O)(nH)2)cccc1Cl
CCOC(=O)CC1=CC(=O)N=C(N1)N=C(N)NC2=C(C(=CC=C2)Cl)C
ETHYL(2((((3CHLORO2METHYLPHENYL)AMINO)(IMINO)METHYL)AMINO)6OXO16DIHYDROPYRIMIDIN4YL)ACETATE
ethyl(2(N(3chloro2methylphenyl)carbamimidamido)6oxo16dihydropyrimidin4yl)acetate
ETHYL2(2((((3CHLORO2METHYLPHENYL)AMINO)IMINOMETHYL)AMINO)6OXOHYDROPYRIMIDIN4YL)ACETATE
ETHYL2(2((AMINO(3CHLORO2METHYLANILINO)METHYLIDENE)AMINO)4OXO1HPYRIMIDIN6YL)ACETATE
InChI=1SC16H18ClN5O3c132514(24)810713(23)2116(1910)2215(18)201264511(17)9(12)2h47H38H212H3(H4181920212223)
MFCD06192076
ZINC000024203487
ZINC24203487

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Available files

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