Vitas-M small molecule compound
(5Z)-5-{[(4-acetylphenyl)amino]methylidene}-1-(3-methoxypropyl)-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Catalog ID
STK991448
SMILES COCCCN1C(=O)/C(=C\Nc2ccc(cc2)C(=O)C)/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 C20H21N3O4 MW 367.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O4/c1-13-17(11-21)19(25)23(9-4-10-27-3)20(26)18(13)12-22-16-7-5-15(6-8-16)14(2)24/h5-8,12,22H,4,9-10H2,1-3H3/b18-12-InChIKey
URMADGLODTUULL-PDGQHHTCSA-NSynonyms
(5Z)5(((4acetylphenyl)amino)methylidene)1(3methoxypropyl)4methyl26dioxo1256tetrahydropyridine3carbonitrile
(5Z)5((4ACETYLANILINO)METHYLIDENE)1(3METHOXYPROPYL)4METHYL26DIOXOPYRIDINE3CARBONITRILE
CC1=C(C(=O)N(C(=O)C1=CNC2=CC=C(C=C2)C(=O)C)CCCOC)C#N
COCCCN1C(=O)C(=CNc2ccc(cc2)C(=O)C)C(=C(C1=O)C#N)C
InChI=1SC20H21N3O4c11317(1121)19(25)23(9410273)20(26)18(13)1222167515(6816)14(2)24h581222H4910H213H3b1812
MFCD07802011
ZINC000005021820
ZINC05021820
ZINC5021820
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