Vitas-M small molecule compound
(5Z)-5-{[(3-bromophenyl)amino]methylidene}-1-(2-methoxyethyl)-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Catalog ID
STK991701
SMILES COCCN1C(=O)/C(=C\Nc2cccc(c2)Br)/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 C17H16BrN3O3 MW 390.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16BrN3O3/c1-11-14(9-19)16(22)21(6-7-24-2)17(23)15(11)10-20-13-5-3-4-12(18)8-13/h3-5,8,10,20H,6-7H2,1-2H3/b15-10-InChIKey
GBVSMOKCSSKRDZ-GDNBJRDFSA-NSynonyms
(5Z)5(((3bromophenyl)amino)methylidene)1(2methoxyethyl)4methyl26dioxo1256tetrahydropyridine3carbonitrile
(5Z)5((3bromoanilino)methylidene)1(2methoxyethyl)4methyl26dioxopyridine3carbonitrile
(Z)5(((3bromophenyl)amino)methylene)1(2methoxyethyl)4methyl26dioxo1256tetrahydropyridine3carbonitrile
CC1=C(C(=O)N(C(=O)C1=CNC2=CC(=CC=C2)Br)CCOC)C#N
COCCN1C(=O)C(=CNc2cccc(c2)Br)C(=C(C1=O)C#N)C
InChI=1SC17H16BrN3O3c11114(919)16(22)21(67242)17(23)15(11)10201353412(18)813h3581020H67H212H3b1510
MFCD09845544
ZINC000009422641
ZINC09422641
ZINC9422641
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