Vitas-M small molecule compound
(2E)-2-(1H-benzimidazol-2-yl)-3-(3-iodophenyl)prop-2-enenitrile
Catalog ID
STL431062
SMILES N#C/C(=C\c1cccc(c1)I)/c1nc2c([nH]1)cccc2
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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 C16H10IN3 MW 371.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10IN3/c17-13-5-3-4-11(9-13)8-12(10-18)16-19-14-6-1-2-7-15(14)20-16/h1-9H,(H,19,20)/b12-8+InChIKey
JJWBHYNUOBAVDQ-XYOKQWHBSA-NSynonyms
(2E)2(1Hbenzimidazol2yl)3(3iodophenyl)prop2enenitrile
(2E)2BENZIMIDAZOL2YL3(3IODOPHENYL)PROP2ENENITRILE
(E)2(1HBENZIMIDAZOL2YL)3(3IODOPHENYL)PROP2ENENITRILE
C1=CC=C2C(=C1)NC(=N2)C(=CC3=CC(=CC=C3)I)C#N
InChI=1SC16H10IN3c171353411(913)812(1018)161914612715(14)2016h19H(H1920)b128+
MFCD04215574
N#CC(=Cc1cccc(c1)I)c1nc2c((nH)1)cccc2
ZINC000004997459
ZINC04997459
ZINC4997459
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