Vitas-M small molecule compound
(5Z)-5-({3-[4-(benzyloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-1-methyl-2,6-dioxo-4-phenyl-1,2,5,6-tetrahydropyridine-3-carbonitrile
Catalog ID
STK515354
SMILES N#CC1=C(c2ccccc2)/C(=C/c2cn(nc2c2ccc(cc2)OCc2ccccc2)c2ccccc2)/C(=O)N(C1=O)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 C36H26N4O3 MW 562.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H26N4O3/c1-39-35(41)31(33(32(22-37)36(39)42)26-13-7-3-8-14-26)21-28-23-40(29-15-9-4-10-16-29)38-34(28)27-17-19-30(20-18-27)43-24-25-11-5-2-6-12-25/h2-21,23H,24H2,1H3/b31-21-InChIKey
SGWQNGDDJDXSCM-YQYKVWLJSA-NSynonyms
(5Z)1methyl26dioxo4phenyl5((1phenyl3(4phenylmethoxyphenyl)pyrazol4yl)methylidene)pyridine3carbonitrile
(5Z)5((3(4(benzyloxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)1methyl26dioxo4phenyl1256tetrahydropyridine3carbonitrile
CN1C(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)OCC4=CC=CC=C4)C5=CC=CC=C5)C(=C(C1=O)C#N)C6=CC=CC=C6
InChI=1SC36H26N4O3c13935(41)31(33(32(2237)36(39)42)26137381426)21282340(291594101629)3834(28)27171930(201827)432425115261225h22123H24H21H3b3121
MFCD06645219
N#CC1=C(c2ccccc2)C(=Cc2cn(nc2c2ccc(cc2)OCc2ccccc2)c2ccccc2)C(=O)N(C1=O)C
ZINC000097946868
ZINC97946868
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