Vitas-M small molecule compound
(2E)-2-(5,6-dimethyl-1H-benzimidazol-2-yl)-3-(1H-pyrrol-2-yl)prop-2-enenitrile
Catalog ID
STL376658
SMILES N#C/C(=C\c1[nH]ccc1)/c1[nH]c2c(n1)cc(c(c2)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 C16H14N4 MW 262.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N4/c1-10-6-14-15(7-11(10)2)20-16(19-14)12(9-17)8-13-4-3-5-18-13/h3-8,18H,1-2H3,(H,19,20)/b12-8+InChIKey
YMBIEGYKQRQUBX-XYOKQWHBSA-NSynonyms
(2E)2(56dimethyl1Hbenzimidazol2yl)3(1Hpyrrol2yl)prop2enenitrile
(E)2(56dimethyl1Hbenzimidazol2yl)3(1Hpyrrol2yl)prop2enenitrile
CC1=CC2=C(C=C1C)N=C(N2)C(=CC3=CC=CN3)C#N
InChI=1SC16H14N4c11061415(711(10)2)2016(1914)12(917)8134351813h3818H12H3(H1920)b128+
MFCD28951139
N#CC(=Cc1(nH)ccc1)c1(nH)c2c(n1)cc(c(c2)C)C
ZINC000076541016
ZINC76541016
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