Vitas-M small molecule compound
(5Z)-5-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]-4-methyl-2,6-dioxo-1-propyl-1,2,5,6-tetrahydropyridine-3-carbonitrile
Catalog ID
STK991715
SMILES CCCN1C(=O)/C(=C\Nc2ccc3c(c2)OCCO3)/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 C19H19N3O4 MW 353.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O4/c1-3-6-22-18(23)14(10-20)12(2)15(19(22)24)11-21-13-4-5-16-17(9-13)26-8-7-25-16/h4-5,9,11,21H,3,6-8H2,1-2H3/b15-11-InChIKey
PTVVCZJGGWHOPO-PTNGSMBKSA-NSynonyms
(5Z)5((23dihydro14benzodioxin6ylamino)methylidene)4methyl26dioxo1propyl1256tetrahydropyridine3carbonitrile
(5Z)5((23dihydro14benzodioxin6ylamino)methylidene)4methyl26dioxo1propylpyridine3carbonitrile
(Z)5(((23dihydrobenzo(b)(14)dioxin6yl)amino)methylene)4methyl26dioxo1propyl1256tetrahydropyridine3carbonitrile
CCCN1C(=O)C(=CNC2=CC3=C(C=C2)OCCO3)C(=C(C1=O)C#N)C
CCCN1C(=O)C(=CNc2ccc3c(c2)OCCO3)C(=C(C1=O)C#N)C
InChI=1SC19H19N3O4c1362218(23)14(1020)12(2)15(19(22)24)112113451617(913)26872516h4591121H368H212H3b1511
MFCD08748224
ZINC000009340605
ZINC09340605
ZINC9340605
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