Vitas-M small molecule compound
4-[(1H-benzimidazol-2-ylmethyl)amino]-5-nitrobenzene-1,2-dicarbonitrile
Catalog ID
STK778225
SMILES N#Cc1cc(NCc2nc3c([nH]2)cccc3)c(cc1C#N)[N+](=O)[O-]
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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 C16H10N6O2 MW 318.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10N6O2/c17-7-10-5-14(15(22(23)24)6-11(10)8-18)19-9-16-20-12-3-1-2-4-13(12)21-16/h1-6,19H,9H2,(H,20,21)InChIKey
VKYSNFCRAOKPNL-UHFFFAOYSA-NSynonyms
4((1Hbenzimidazol2ylmethyl)amino)5nitrobenzene12dicarbonitrile
4(1HBENZIMIDAZOL2YLMETHYLAMINO)5NITROBENZENE12DICARBONITRILE
C1=CC=C2C(=C1)NC(=N2)CNC3=C(C=C(C(=C3)C#N)C#N)(N+)(=O)(O)
InChI=1SC16H10N6O2c17710514(15(22(23)24)611(10)818)199162012312413(12)2116h1619H9H2(H2021)
MFCD05855984
N#Cc1cc(NCc2nc3c((nH)2)cccc3)c(cc1C#N)(N+)(=O)(O)
ZINC000004697959
ZINC04697959
ZINC4697959
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