Vitas-M small molecule compound
1-(4-methylphenyl)-5-{[(E)-pyrrolidin-1-ylmethylidene]amino}-1H-pyrazole-4-carbonitrile
Catalog ID
STK206665
SMILES N#Cc1cnn(c1/N=C/N1CCCC1)c1ccc(cc1)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 C16H17N5 MW 279.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N5/c1-13-4-6-15(7-5-13)21-16(14(10-17)11-19-21)18-12-20-8-2-3-9-20/h4-7,11-12H,2-3,8-9H2,1H3/b18-12+InChIKey
XUGCYAMWEFTMEO-LDADJPATSA-NSynonyms
1(4methylphenyl)5(((E)pyrrolidin1ylmethylidene)amino)1Hpyrazole4carbonitrile
1(4methylphenyl)5((E)pyrrolidin1ylmethylideneamino)pyrazole4carbonitrile
CC1=CC=C(C=C1)N2C(=C(C=N2)C#N)N=CN3CCCC3
InChI=1SC16H17N5c1134615(7513)2116(14(1017)111921)181220823920h471112H2389H21H3b1812+
MFCD08677896
N#Cc1cnn(c1N=CN1CCCC1)c1ccc(cc1)C
ZINC000000505620
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