Vitas-M small molecule compound

methyl 2-chloro-5-({[3-cyano-4-(methoxymethyl)-6-methyl-2-oxopyridin-1(2H)-yl]acetyl}amino)benzoate

Catalog ID
STK285266
SMILES COCc1cc(C)n(c(=O)c1C#N)CC(=O)Nc1ccc(c(c1)C(=O)OC)Cl

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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 C19H18ClN3O5 MW 403.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClN3O5/c1-11-6-12(10-27-2)15(8-21)18(25)23(11)9-17(24)22-13-4-5-16(20)14(7-13)19(26)28-3/h4-7H,9-10H2,1-3H3,(H,22,24)
InChIKey
CPQJRJQPJVRLFS-UHFFFAOYSA-N
Synonyms

CC1=CC(=C(C(=O)N1CC(=O)NC2=CC(=C(C=C2)Cl)C(=O)OC)C#N)COC
InChI=1SC19H18ClN3O5c111612(10272)15(821)18(25)23(11)917(24)22134516(20)14(713)19(26)283h47H910H213H3(H2224)
METHYL2CHLORO5(((3CYANO4(METHOXYMETHYL)6METHYL2OXOPYRIDIN1(2H)YL)ACETYL)AMINO)BENZOATE
METHYL2CHLORO5((2(3CYANO4(METHOXYMETHYL)6METHYL2OXOPYRIDIN1YL)ACETYL)AMINO)BENZOATE
MFCD06010480
ZINC000000810887
ZINC00810887
ZINC810887

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Available files

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