Vitas-M small molecule compound
methyl 2-({(Z)-[5-cyano-1-(3-methoxypropyl)-4-methyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene]methyl}amino)benzoate
Catalog ID
STK991718
SMILES COCCCN1C(=O)/C(=C\Nc2ccccc2C(=O)OC)/C(=C(C1=O)C#N)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 C20H21N3O5 MW 383.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O5/c1-13-15(11-21)18(24)23(9-6-10-27-2)19(25)16(13)12-22-17-8-5-4-7-14(17)20(26)28-3/h4-5,7-8,12,22H,6,9-10H2,1-3H3/b16-12-InChIKey
UMSDJQANHMCZNX-VBKFSLOCSA-NSynonyms
(Z)methyl2(((5cyano1(3methoxypropyl)4methyl26dioxo16dihydropyridin3(2H)ylidene)methyl)amino)benzoate
CC1=C(C(=O)N(C(=O)C1=CNC2=CC=CC=C2C(=O)OC)CCCOC)C#N
COCCCN1C(=O)C(=CNc2ccccc2C(=O)OC)C(=C(C1=O)C#N)C
InChI=1SC20H21N3O5c11315(1121)18(24)23(9610272)19(25)16(13)122217854714(17)20(26)283h45781222H6910H213H3b1612
methyl2(((Z)(5cyano1(3methoxypropyl)4methyl26dioxo16dihydropyridin3(2H)ylidene)methyl)amino)benzoate
methyl2(((Z)(5cyano1(3methoxypropyl)4methyl26dioxopyridin3ylidene)methyl)amino)benzoate
MFCD08748612
ZINC000009341520
ZINC09341520
ZINC9341520
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