Vitas-M small molecule compound
2-[3-cyano-4-(methoxymethyl)-6-methyl-2-oxopyridin-1(2H)-yl]-N'-{(1E)-2-[1-(3,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]ethylidene}acetohydrazide
Catalog ID
STK081045
SMILES COCc1cc(C)n(c(=O)c1C#N)CC(=O)N/N=C/Cc1cc(n(c1C)c1ccc(c(c1)C)C)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 C27H31N5O3 MW 473.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N5O3/c1-17-7-8-24(11-18(17)2)32-20(4)13-22(21(32)5)9-10-29-30-26(33)15-31-19(3)12-23(16-35-6)25(14-28)27(31)34/h7-8,10-13H,9,15-16H2,1-6H3,(H,30,33)/b29-10+InChIKey
JGTUISHGNNVLTB-VYVUJPJFSA-NSynonyms
2(3CYANO4(METHOXYMETHYL)6METHYL2OXOPYRIDIN1(2H)YL)N((1E)2(1(34DIMETHYLPHENYL)25DIMETHYL1HPYRROL3YL)ETHYLIDENE)ACETOHYDRAZIDE
2(3cyano4(methoxymethyl)6methyl2oxopyridin1yl)N((E)2(1(34dimethylphenyl)25dimethylpyrrol3yl)ethylideneamino)acetamide
CC1=C(C=C(C=C1)N2C(=CC(=C2C)CC=NNC(=O)CN3C(=CC(=C(C3=O)C#N)COC)C)C)C
COCc1cc(C)n(c(=O)c1C#N)CC(=O)NN=CCc1cc(n(c1C)c1ccc(c(c1)C)C)C
InChI=1SC27H31N5O3c1177824(1118(17)2)3220(4)1322(21(32)5)910293026(33)153119(3)1223(16356)25(1428)27(31)34h781013H91516H216H3(H3033)b2910+
MFCD05040328
STK081045
ZINC000015018580
ZINC60117792
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